1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
473
474
475
476
477
478
479
480
481
482
483
484
485
486
487
488
489
490
491
492
493
494
495
496
497
498
499
500
501
502
503
504
505
506
507
508
509
510
511
512
513
514
515
516
517
518
519
520
521
522
523
524
525
526
527
528
529
530
531
532
533
534
535
536
537
538
539
540
541
542
543
544
545
546
547
548
549
550
551
552
553
554
555
556
557
558
559
560
561
562
563
564
565
566
567
568
569
570
571
572
573
574
575
576
577
578
579
580
581
582
583
584
585
586
587
588
589
590
591
592
593
594
595
596
597
598
599
600
601
602
603
604
605
606
607
608
609
610
611
612
613
614
615
616
617
618
619
620
621
622
623
624
625
626
627
628
629
630
631
632
633
634
635
636
637
638
639
640
641
642
643
644
645
646
647
648
649
650
651
652
653
654
655
656
657
|
thermo
300.000 1000.000 5000.000
C(S) J 3/61C 1.0 0.0 0.0 0.S 300.000 5000.000
.13604942E+01 .19182237E-02 -.84040389E-06 .16448707E-09 -.11672670E-13
-.65713870E+03 -.80070207E+01 -.44778053E+00 .53691002E-02 -.39775571E-06
-.40459298E-08 .21134939E-11 -.94280688E+02 .16840791E+01
C J 3/61C 1.00 0.00 0.00 0.G 300.000 5000.000
.25810663E+01 -.14696202E-03 .74388084E-07 -.79481079E-11 .58900977E-16
.85216294E+05 .43128879E+01 .25328705E+01 -.15887641E-03 .30682082E-06
-.26770064E-09 .87488827E-13 .85240422E+05 .46062374E+01
C+ L12/66C 1.E -1.00 0.00 0.G 300.000 5000.000
.25118274E+01 -.17359784E-04 .95042676E-08 -.22188518E-11 .18621892E-15
.21667721E+06 .42861298E+01 .25953840E+01 -.40686645E-03 .68923669E-06
-.52664878E-09 .15083377E-12 .21666281E+06 .38957298E+01
C- J 9/65C 1.E 1.00 0.00 0.G 300.000 5000.000
.24470591E+01 .11286428E-03 -.78591462E-07 .19778614E-10 -.11105555E-14
.69972969E+05 .42356992E+01 .24925640E+01 .53153068E-04 -.13307994E-06
.13951379E-09 -.52150992E-13 .69955757E+05 .39811657E+01
CCL J12/69C 1.CL 1.0 0.0 0.G 300.000 5000.000
.40984727E+01 .50077845E-03 -.20012833E-06 .38680992E-10 -.25441113E-14
.59076599E+05 .33370201E+01 .31953557E+01 .28076318E-02 -.16043845E-05
-.57744065E-09 .61409732E-12 .59325077E+05 .80220197E+01
CCL2 J12/68C 1.CL 2.0 0.0 0.G 300.000 5000.000
.37184999E+01 .53449745E-02 -.23431284E-05 .41806177E-09 -.26765295E-13
.27554793E+05 .96328274E+01 .28588505E+01 .13957938E-01 -.20038898E-04
.13500726E-07 -.31669715E-11 .27363926E+05 .12230161E+02
CCL2F2 J 6/70C 1.CL 2.F 2. 0.G 300.000 5000.000
.10381031E+02 .29646161E-02 -.13103005E-05 .25625459E-09 -.18449697E-13
-.62784386E+05 -.24829918E+02 .15974049E+01 .36382427E-01 -.51940779E-04
.36230035E-07 -.99959359E-11 -.60830787E+05 .18245759E+02
CCL3 J 6/70C 1.CL 3.0 0.0 0.G 300.000 5000.000
.87815473E+01 .13516130E-02 -.58249453E-06 .11098697E-09 -.77937264E-14
.66344151E+04 -.15329284E+02 .37153357E+01 .19443796E-01 -.24627841E-04
.13786464E-07 -.26638934E-11 .77820020E+04 .97028910E+01
CCL3F J 6/70C 1.CL 3.F 1. 0.G 300.000 5000.000
.10986599E+02 .22916018E-02 -.10162217E-05 .19917607E-09 -.14361911E-13
-.38468983E+05 -.26898289E+02 .23331266E+01 .37352373E-01 -.57591855E-04
.42746118E-07 -.12392969E-10 -.36648367E+05 .15017166E+02
CCL4 J12/68C 1.CL 4.0 0.0 0.G 300.000 5000.000
.11601304E+02 .15550273E-02 -.67045280E-06 .12770337E-09 -.89616950E-14
-.15389852E+05 -.30063473E+02 .42667400E+01 .29452637E-01 -.40820650E-04
.25581544E-07 -.58756489E-11 -.13810816E+05 .57614468E+01
CF J 6/70C 1.F 1.0 0.0 0.G 300.000 5000.000
.36869679E+01 .91143491E-03 -.36463855E-06 .67482854E-10 -.45269596E-14
.29478125E+05 .41613468E+01 .34655143E+01 -.68779805E-03 .56784766E-05
-.64582982E-08 .22988248E-11 .29655598E+05 .58681916E+01
CF+ J12/70C 1.F 1.E -1.0 0.G 300.000 5000.000
.36089986E+01 .98627001E-03 -.39514130E-06 .73142716E-10 -.49773164E-14
.13704674E+06 .38918614E+01 .34305942E+01 -.77491625E-03 .58009484E-05
-.64435448E-08 .22552103E-11 .13721751E+06 .53945582E+01
CF2 J 6/70C 1.F 2.0 0.0 0.G 300.000 5000.000
.52267142E+01 .20837680E-02 -.99037278E-06 .21264848E-09 -.15831114E-13
-.23755847E+05 -.19240670E+01 .27688821E+01 .72372962E-02 -.16028152E-05
-.45512379E-08 .26648011E-11 -.23015786E+05 .11124533E+02
CF2+ J12/70C 1.F 2.E -1.0 0.G 300.000 5000.000
.51554230E+01 .20528310E-02 -.91173911E-06 .18272761E-09 -.13213640E-13
.11143122E+06 -.79191320E+00 .29783522E+01 .60336602E-02 .65858785E-09
-.52129449E-08 .26663021E-11 .11212675E+06 .10938410E+02
CF3 J 6/69C 1.F 3.0 0.0 0.G 300.000 5000.000
.72012622E+01 .30663935E-02 -.13144181E-05 .24996925E-09 -.17550928E-13
-.59238631E+05 -.10958873E+02 .20650168E+01 .16424158E-01 -.10838146E-04
-.85317997E-09 .23878070E-11 -.57811976E+05 .15691530E+02
CF3+ J12/71C 1.F 3.E -1. 0.G 300.000 5000.000
.70225406E+01 .32441271E-02 -.13864875E-05 .26323637E-09 -.18464402E-13
.48022318E+05 -.11219685E+02 .22605576E+01 .15422323E-01 -.98956674E-05
-.78345046E-09 .21211892E-11 .49365338E+05 .13565304E+02
CF4 J 6/69C 1.F 4.0 0.0 0.G 300.000 5000.000
.91644298E+01 .41978941E-02 -.17971486E-05 .34132082E-09 -.23934115E-13
-.11571355E+06 -.23292961E+02 .11656107E+01 .27177786E-01 -.23317677E-04
.55706566E-08 .12861856E-11 -.11360052E+06 .17670656E+02
CH J12/67C 1.H 1.0 0.0 0.G 300.000 5000.000
.22673116E+01 .22043000E-02 -.62250191E-06 .69689940E-10 -.21274952E-14
.70838037E+05 .87889352E+01 .35632752E+01 -.20031372E-03 -.40129814E-06
.18226922E-08 -.86768311E-12 .70405506E+05 .17628023E+01
CH+ J12/71C 1.H 1.E -1. 0.G 300.000 5000.000
.27466401E+01 .15496991E-02 -.52858324E-06 .86132075E-10 -.50909775E-14
.19483672E+06 .46994695E+01 .35601593E+01 -.22478101E-03 -.26341623E-06
.16716214E-08 -.89478626E-12 .19460363E+06 .41570213E+00
CH2 J12/72C 1.H 2. 0. 0.G 300.000 5000.000
.27525479E+01 .39782047E-02 -.14921731E-05 .25956899E-09 -.17110673E-13
.45547759E+05 .66534799E+01 .35883347E+01 .21724137E-02 -.13323408E-05
.19469445E-08 -.89431394E-12 .45315188E+05 .22627869E+01
CH2O J 3/61C 1.H 2.O 1.0 0.G 300.000 5000.000
.28364249E+01 .68605298E-02 -.26882647E-05 .47971258E-09 -.32118406E-13
-.15236031E+05 .78531169E+01 .37963783E+01 -.25701785E-02 .18548815E-04
-.17869177E-07 .55504451E-11 -.15088947E+05 .47548163E+01
CH3 J 6/69C 1.H 3.0 0.0 0.G 300.000 5000.000
.28400327E+01 .60869086E-02 -.21740338E-05 .36042576E-09 -.22725300E-13
.16449813E+05 .55056751E+01 .34666350E+01 .38301845E-02 .10116802E-05
-.18859236E-08 .66803182E-12 .16313104E+05 .24172192E+01
CH3CL J 6/72C 1.H 3.CL 1. 0.G 300.000 5000.000
.33525395E+01 .91076335E-02 -.35803742E-05 .64717936E-09 -.44094205E-13
-.11654863E+05 .60251042E+01 .23187191E+01 .72750822E-02 .82029077E-05
-.13787596E-07 .54737706E-11 -.11127406E+05 .12539518E+02
CH4 J 3/61C 1.H 4.00 0.00 0.G 300.000 5000.000
.15027072E+01 .10416798E-01 -.39181522E-05 .67777899E-09 -.44283706E-13
-.99787078E+04 .10707143E+02 .38261932E+01 -.39794581E-02 .24558340E-04
-.22732926E-07 .69626957E-11 -.10144950E+05 .86690073E+00
CN J 6/69C 1.N 1.0 0.0 0.G 300.000 5000.000
.36036285E+01 .33644390E-03 .10028933E-06 -.16318166E-10 -.36286722E-15
.51159833E+05 .35454505E+01 .37386307E+01 -.19239224E-02 .47035189E-05
-.31113000E-08 .61675318E-12 .51270927E+05 .34490218E+01
CN+ J12/70C 1.N 1.E -1.0 0.G 300.000 5000.000
.36522919E+01 .81427579E-03 -.20853348E-06 .29071604E-10 -.17865094E-14
.21560182E+06 .43916910E+01 .36175018E+01 -.20179550E-02 .79359855E-05
-.77300616E-08 .24798477E-11 .21578134E+06 .53579527E+01
CN- J12/70C 1.N 1.E 1.0 0.G 300.000 5000.000
.29471725E+01 .14988427E-02 -.57579547E-06 .10177789E-09 -.67478503E-14
.63644338E+04 .63743952E+01 .37034310E+01 -.14896426E-02 .31864701E-05
-.14831305E-08 .48121663E-13 .62335826E+04 .27722843E+01
CNN J 6/66C 1.N 2.00 0.00 0.G 300.000 5000.000
.48209077E+01 .24790014E-02 -.94644109E-06 .16548764E-09 -.10899129E-13
.68685948E+05 -.48484039E+00 .35077779E+01 .72023958E-02 -.75574589E-05
.42979217E-08 -.94257935E-12 .68994281E+05 .60234964E+01
CN2 J12/70C 1.N 2.0 0.0 0.G 300.000 5000.000
.55626268E+01 .20860606E-02 -.88123724E-06 .16505783E-09 -.11366697E-13
.54897907E+05 -.55989355E+01 .32524003E+01 .70010737E-02 -.22653599E-05
-.28939808E-08 .18270077E-11 .55609085E+05 .66966778E+01
CO J 9/65C 1.O 1.00 0.00 0.G 300.000 5000.000
.29840696E+01 .14891390E-02 -.57899684E-06 .10364577E-09 -.69353550E-14
-.14245228E+05 .63479156E+01 .37100928E+01 -.16190964E-02 .36923594E-05
-.20319674E-08 .23953344E-12 -.14356310E+05 .29555351E+01
COCL J12/65C 1.O 1.CL 1.00 0.G 300.000 5000.000
.54291236E+01 .16121535E-02 -.66006280E-06 .12127114E-09 -.82858601E-14
-.93305007E+04 .36971816E+00 .42863792E+01 .50868980E-02 -.50729411E-05
.29647983E-08 -.77093453E-12 -.90125212E+04 .62380308E+01
COCLF J 6/61C 1.O 1.CL 1.F 1.G 300.000 5000.000
.70881081E+01 .31816479E-02 -.13763316E-05 .26544005E-09 -.18928969E-13
-.53883781E+05 -.86981512E+01 .17066661E+01 .22722565E-01 -.30115639E-04
.20483566E-07 -.56572228E-11 -.52619902E+05 .17974468E+02
COCL2 J 6/61C 1.O 1.CL 2.00 0.G 300.000 5000.000
.77318082E+01 .24089287E-02 -.10111133E-05 .18936214E-09 -.13139356E-13
-.29136566E+05 -.11221674E+02 .31156139E+01 .18478674E-01 -.22420544E-04
.12868184E-07 -.27360805E-11 -.28043884E+05 .11755299E+02
COF J12/65C 1.O 1.F 1.00 0.G 300.000 5000.000
.48908214E+01 .22179703E-02 -.92550725E-06 .17270120E-09 -.11955343E-13
-.22357984E+05 .97962087E+00 .32019727E+01 .55837770E-02 -.14905481E-05
-.23126069E-08 .13614353E-11 -.21817043E+05 .10047576E+02
COF2 J12/69C 1.O 1.F 2.0 0.G 300.000 5000.000
.65540365E+01 .36729542E-02 -.15470211E-05 .29065749E-09 -.20226548E-13
-.79321725E+05 -.81127751E+01 .17973047E+01 .16588712E-01 -.12553807E-04
.20091842E-08 .11090061E-11 -.78009422E+05 .16478049E+02
COS J 3/61C 1.O 1.S 1.00 0.G 300.000 5000.000
.52392000E+01 .24100584E-02 -.96064522E-06 .17778347E-09 -.12235704E-13
-.18480455E+05 -.30910517E+01 .24625321E+01 .11947992E-01 -.13794370E-04
.80707736E-08 -.18327653E-11 -.17803987E+05 .10792556E+02
CO2 J 9/65C 1.O 2.00 0.00 0.G 300.000 5000.000
.44608041E+01 .30981719E-02 -.12392571E-05 .22741325E-09 -.15525954E-13
-.48961442E+05 -.98635982E+00 .24007797E+01 .87350957E-02 -.66070878E-05
.20021861E-08 .63274039E-15 -.48377527E+05 .96951457E+01
CO2- J12/66C 1.O 2.E 1.00 0.G 300.000 5000.000
.45454640E+01 .26054316E-02 -.10928732E-05 .20454421E-09 -.14184542E-13
-.54761968E+05 .18317369E+01 .34743737E+01 .16913805E-02 .73533803E-05
-.99554255E-08 .36846719E-11 -.54249049E+05 .83834329E+01
CP J 6/62C 1.P 1.00 0.00 0.G 300.000 5000.000
.37436112E+01 .83811486E-03 -.34116216E-06 .63775863E-10 -.44094630E-14
.54969175E+05 .42305583E+01 .32385857E+01 .51754367E-03 .35657389E-05
-.48985936E-08 .18766551E-11 .55196565E+05 .72701279E+01
CS J12/76C 1.S 1. 0. 0.G 300.000 5000.000
.36826012E+01 .90473203E-03 -.36436374E-06 .63854294E-10 -.36933982E-14
.32497490E+05 .38850496E+01 .34039344E+01 -.65773308E-03 .61712157E-05
-.73689604E-08 .27346738E-11 .32689393E+05 .58977001E+01
CS2 J12/76C 1.S 2. 0. 0.G 300.000 5000.000
.59252610E+01 .18252996E-02 -.75585380E-06 .14605073E-09 -.10438595E-13
.12048071E+05 -.60723317E+01 .28326013E+01 .13290791E-01 -.18144694E-04
.12831681E-07 -.36800609E-11 .12766782E+05 .92087947E+01
C2 J12/69C 2.0 0.0 0.0 0.G 300.000 5000.000
.40435359E+01 .20573654E-03 .10907575E-06 -.36427874E-10 .34127865E-14
.99709486E+05 .12775158E+01 .74518140E+01 -.10144686E-01 .85879735E-05
.87321100E-09 -.24429792E-11 .98911989E+05 -.15846678E+02
C2- J12/69C 2.E 1.0 0.0 0.G 300.000 5000.000
.36926257E+01 .41576040E-03 .11654211E-07 .23755880E-11 -.14585314E-14
.52118953E+05 .22470173E+01 .37342914E+01 -.23034649E-02 .68417833E-05
-.58120827E-08 .16604296E-11 .52281427E+05 .27860423E+01
C2CL2 J12/68C 2.CL 2.0 0.0 0.G 300.000 5000.000
.81728547E+01 .23659892E-02 -.96552505E-06 .17736148E-09 -.12135203E-13
.22510190E+05 -.14916744E+02 .50229482E+01 .14082667E-01 -.18095669E-04
.11610348E-07 -.28817478E-11 .23227482E+05 .59684170E+00
C2F2 J12/67C 2.F 2.0 0.0 0.G 300.000 5000.000
.75164581E+01 .31686462E-02 -.13311385E-05 .24960049E-09 -.17342072E-13
-.16107655E+03 -.15081225E+02 .35345837E+01 .14445845E-01 -.12189692E-04
.36042985E-08 .19118951E-12 .92133562E+03 .54063023E+01
C2F4 J 6/69C 2.F 4.0 0.0 0.G 300.000 5000.000
.11086468E+02 .52788429E-02 -.22354400E-05 .42166846E-09 -.29433914E-13
-.83292884E+05 -.29880044E+02 .36166183E+01 .26488618E-01 -.22433266E-04
.62286445E-08 .62149244E-12 -.81277242E+05 .85106010E+01
C2H J 3/67C 2.H 1.00 0.00 0.G 300.000 5000.000
.44207650E+01 .22119303E-02 -.59294945E-06 .94195775E-10 -.68527594E-14
.55835444E+05 -.11588093E+01 .26499400E+01 .84919515E-02 -.98165375E-05
.65373629E-08 -.17356273E-11 .56275751E+05 .76898609E+01
C2HF J12/67C 2.H 1.F 1.0 0.G 300.000 5000.000
.60949501E+01 .39432428E-02 -.14711438E-05 .25294641E-09 -.16446663E-13
.12976907E+05 -.83285075E+01 .26901770E+01 .17680853E-01 -.22749855E-04
.14920568E-07 -.37381925E-11 .13683223E+05 .81338073E+01
C2H2 J 3/61C 2.H 2.00 0.00 0.G 300.000 5000.000
.45751083E+01 .51238358E-02 -.17452354E-05 .28673065E-09 -.17951426E-13
.25607428E+05 -.35737940E+01 .14102768E+01 .19057275E-01 -.24501390E-04
.16390872E-07 -.41345447E-11 .26188208E+05 .11393827E+02
C2H4 J 9/65C 2.H 4.00 0.00 0.G 300.000 5000.000
.34552152E+01 .11491803E-01 -.43651750E-05 .76155095E-09 -.50123200E-13
.44773119E+04 .26987959E+01 .14256821E+01 .11383140E-01 .79890006E-05
-.16253679E-07 .67491256E-11 .53370755E+04 .14621819E+02
C2H6 L 5/72C 2.H 6. 0. 0.G 300.000 1500.000
.21555281E+01 .14779861E-01 .23352804E-05 -.64146428E-08 .19036925E-11
-.11524517E+05 .10776316E+02 .21415788E+01 .10529720E-01 .18730274E-04
-.26691187E-07 .10049332E-10 -.11410486E+05 .11647757E+02
C2N J 3/67C 2.N 1.00 0.00 0.G 300.000 5000.000
.61931308E+01 .14327539E-02 -.61255161E-06 .11578707E-09 -.80401339E-14
.64818372E+05 -.84132298E+01 .32670394E+01 .98211307E-02 -.83284733E-05
.17650559E-08 .59632768E-12 .65589057E+05 .65682304E+01
C2N2 J 3/61C 2.N 2.00 0.00 0.G 300.000 5000.000
.65968935E+01 .38694131E-02 -.15516161E-05 .28141546E-09 -.19069442E-13
.34883726E+05 -.10001801E+02 .39141782E+01 .14011008E-01 -.17404350E-04
.12012779E-07 -.33565772E-11 .35514550E+05 .32384353E+01
C2O J 9/66C 2.O 1.00 0.00 0.G 300.000 5000.000
.48990313E+01 .28430384E-02 -.10209669E-05 .16112165E-09 -.95542914E-14
.32800545E+05 -.91382280E+00 .35364815E+01 .69543872E-02 -.53071374E-05
.17030470E-08 -.14108072E-13 .33151572E+05 .60172370E+01
C3 J12/69C 3.0 0.0 0.0 0.G 300.000 5000.000
.36815361E+01 .24165236E-02 -.84348112E-06 .14508198E-09 -.95697300E-14
.97413955E+05 .68377802E+01 .57408464E+01 -.84281238E-02 .18620198E-04
-.14510529E-07 .39676977E-11 .97157524E+05 -.23837376E+01
C3O2 J 6/68C 3.O 2.0 0.0 0.G 300.000 5000.000
.81435964E+01 .54395018E-02 -.22192869E-05 .40778627E-09 -.27915974E-13
-.14230013E+05 -.15456769E+02 .37161005E+01 .19872164E-01 -.20935751E-04
.11750112E-07 -.26589416E-11 -.13089402E+05 .69298412E+01
C4 J12/69C 4.0 0.0 0.0 0.G 300.000 5000.000
.65602101E+01 .40985234E-02 -.17000471E-05 .31615228E-09 -.21842144E-13
.11430434E+06 -.11820311E+02 .18432021E+01 .19343592E-01 -.20627502E-04
.10822626E-07 -.21289203E-11 .11550276E+06 .12006898E+02
C5 J12/69C 5.0 0.0 0.0 0.G 300.000 5000.000
.82067016E+01 .54889888E-02 -.22694876E-05 .42073365E-09 -.28981924E-13
.11463647E+06 -.20246108E+02 .11012446E+01 .29513421E-01 -.33754342E-04
.19056534E-07 -.40989018E-11 .11637970E+06 .15360193E+02
H J 3/77H 1. 0. 0. 0.G 300.000 5000.000
.25000000E+01 .00000000 .00000000 .00000000 .00000000
.25474390E+05 -.45989841E+00 .25000000E+01 .00000000 .00000000
.00000000 .00000000 .25474390E+05 -.45989841E+00
H+ J 3/77H 1.E -1. 0. 0.G 300.000 5000.000
.25000000E+01 .00000000 .00000000 .00000000 .00000000
.18402589E+06 -.11538622E+01 .25000000E+01 .00000000 .00000000
.00000000 .00000000 .18402589E+06 -.11538622E+01
H- J 3/77H 1.E 1. 0. 0.G 300.000 5000.000
.25000000E+01 .00000000 .00000000 .00000000 .00000000
.15976437E+05 -.11522295E+01 .25000000E+01 .00000000 .00000000
.00000000 .00000000 .15976437E+05 -.11522295E+01
HALO J 3/64H 1.AL 1.O 1.00 0.G 300.000 5000.000
.48556053E+01 .28598933E-02 -.12152821E-05 .22966419E-09 -.16047592E-13
.21454053E+04 -.32954978E+01 .18980220E+01 .77763784E-02 .15224672E-05
-.86530734E-08 .41700380E-11 .31156301E+04 .12763795E+02
HBO J12/75H 1.B 1.O 1. 0.G 300.000 5000.000
.37485181E+01 .36610859E-02 -.14635409E-05 .26519903E-09 -.17834275E-13
-.25225798E+05 .17332585E+01 .22143106E+01 .93718513E-02 -.10711074E-04
.76769774E-08 -.23586371E-11 -.24849246E+05 .93587977E+01
HBO+ J12/75H 1.B 1.O 1.E -1.G 300.000 5000.000
.39475080E+01 .34315436E-02 -.12787084E-05 .22180604E-09 -.14757192E-13
.14135998E+06 .19857064E+01 .22544283E+01 .80301872E-02 -.59749072E-05
.24281950E-08 -.43051124E-12 .14185069E+06 .10799018E+02
HBO- J12/75H 1.B 1.O 1.E 1.G 300.000 5000.000
.40869265E+01 .29784756E-02 -.12387107E-05 .24693335E-09 -.18455048E-13
-.30930026E+05 .27668939E+01 .39707955E+01 -.22100107E-02 .14535413E-04
-.15638925E-07 .53978966E-11 -.30589499E+05 .48117211E+01
HBO2 J12/64H 1.B 1.O 2.00 0.G 300.000 5000.000
.47389519E+01 .47718771E-02 -.18063494E-05 .31492889E-09 -.20738312E-13
-.69248838E+05 -.33346713E-02 .28707866E+01 .78862644E-02 -.40736842E-06
-.47059022E-08 .23548893E-11 -.68624111E+05 .10167320E+02
HBS J12/75H 1.B 1.S 1. 0.G 300.000 5000.000
.44412265E+01 .29979825E-02 -.11938230E-05 .21195832E-09 -.13466097E-13
.44402975E+04 -.66018681E+00 .15595903E+01 .13966838E-01 -.17988595E-04
.12315141E-07 -.34090957E-11 .50890936E+04 .13488495E+02
HBS+ J12/75H 1.B 1.S 1.E -1.G 300.000 5000.000
.47097542E+01 .28187036E-02 -.11633088E-05 .21768839E-09 -.15108686E-13
.13419139E+06 -.85085708E+00 .22511561E+01 .12077168E-01 -.15322156E-04
.10494090E-07 -.29325292E-11 .13475476E+06 .11257385E+02
HBR J 9/65H 1.BR 1. 0. 0.G 300.000 5000.000
.27935804E+01 .15655925E-02 -.56171064E-06 .95783142E-10 -.61813990E-14
-.52338384E+04 .76423703E+01 .36056690E+01 -.59529431E-03 .65029568E-06
.93781219E-09 -.71141852E-12 -.54389455E+04 .34831774E+01
HCL J 9/64H 1.CL 1.00 0.00 0.G 300.000 5000.000
.27665884E+01 .14381883E-02 -.46993000E-06 .73499408E-10 -.43731106E-14
-.11917468E+05 .64583540E+01 .35248171E+01 .29984862E-04 -.86221891E-06
.20979721E-08 -.98658191E-12 -.12150509E+05 .23957713E+01
HCN L12/69H 1.C 1.N 1.0 0.G 300.000 5000.000
.37068121E+01 .33382803E-02 -.11913320E-05 .19992917E-09 -.12826452E-13
.14962636E+05 .20794904E+01 .24513556E+01 .87208371E-02 -.10094203E-04
.67255698E-08 -.17626959E-11 .15213002E+05 .80830085E+01
HCO J12/70H 1.C 1.O 1.0 0.G 300.000 5000.000
.34738348E+01 .34370227E-02 -.13632664E-05 .24928645E-09 -.17044331E-13
.39594005E+04 .60453340E+01 .38840192E+01 -.82974448E-03 .77900809E-05
-.70616962E-08 .19971730E-11 .40563860E+04 .48354133E+01
HCO+ J12/70H 1.C 1.O 1.E -1.G 300.000 5000.000
.37411880E+01 .33441517E-02 -.12397121E-05 .21189388E-09 -.13704150E-13
.98884078E+05 .20654768E+01 .24739736E+01 .86715590E-02 -.10031500E-04
.67170527E-08 -.17872674E-11 .99146608E+05 .81625751E+01
HCP J12/69H 1.C 1.P 1.0 0.G 300.000 5000.000
.44720009E+01 .26742145E-02 -.97089571E-06 .15708386E-09 -.88457131E-14
.18558085E+05 -.68781355E+00 .21111132E+01 .10707664E-01 -.10801743E-04
.49036970E-08 -.59717249E-12 .19110209E+05 .11067474E+02
HF J12/68H 1.F 1.0 0.0 0.G 300.000 5000.000
.30019188E+01 .69528935E-03 -.56135180E-07 -.14767711E-10 .22140435E-14
-.33624997E+05 .37575868E+01 .34659720E+01 .33246861E-03 -.10063786E-05
.12078301E-08 -.37137269E-12 -.33821824E+05 .10758272E+01
HI J 9/61H 1.I 1. 0. 0.G 300.000 5000.000
.29104008E+01 .15688188E-02 -.59227632E-06 .10537094E-09 -.70375116E-14
.22508659E+04 .78513074E+01 .36963722E+01 -.14224755E-02 .30131188E-05
-.12666403E-08 -.35098765E-13 .21073581E+04 .40749580E+01
HNCO J12/70H 1.N 1.C 1.O 1.G 300.000 5000.000
.51300390E+01 .43551371E-02 -.16269022E-05 .28035605E-09 -.18276037E-13
-.14101787E+05 -.22010995E+01 .23722164E+01 .13664040E-01 -.13323158E-04
.64475457E-08 -.10402894E-11 -.13437059E+05 .11588263E+02
HNO J 3/63H 1.N 1.O 1.0 0.G 300.000 5000.000
.35548619E+01 .32713182E-02 -.12734071E-05 .22602046E-09 -.15064827E-13
.10693734E+05 .51684901E+01 .37412008E+01 -.20067061E-03 .75409300E-05
-.79105713E-08 .25928389E-11 .10817845E+05 .50063473E+01
HNO2 J 6/63H 1.N 1.O 2. 0.G 300.000 5000.000
.55144941E+01 .41394403E-02 -.15878702E-05 .27977639E-09 -.18584209E-13
-.11276885E+05 -.31425253E+01 .25098874E+01 .12171605E-01 -.78618375E-05
.35351571E-09 .11540858E-11 -.10450008E+05 .12399634E+02
HNO3 J 6/63H 1.N 1.O 3. 0.G 300.000 5000.000
.70591100E+01 .56769446E-02 -.22348863E-05 .40155529E-09 -.27080510E-13
-.18920009E+05 -.10778285E+02 .14377135E+01 .20903552E-01 -.14574553E-04
.11972023E-08 .19117285E-11 -.17385368E+05 .18246253E+02
HOF J12/72H 1.O 1.F 1. 0.G 300.000 5000.000
.40464336E+01 .24486283E-02 -.86283553E-06 .14209904E-09 -.89356915E-14
-.13209067E+05 .33367680E+01 .32310929E+01 .37389857E-02 .63009762E-06
-.36215002E-08 .17867133E-11 -.12954779E+05 .77377387E+01
HO2 J 3/64H 1.O 2.00 0.00 0.G 300.000 5000.000
.37866280E+01 .27885404E-02 -.10168708E-05 .17183946E-09 -.11021852E-13
.11888500E+04 .48147611E+01 .35094850E+01 .11499670E-02 .58784259E-05
-.77795519E-08 .29607883E-11 .13803331E+04 .68276325E+01
HSO3F J 6/72H 1.S 1.O 3.F 1.G 300.000 5000.000
.10364190E+02 .53861164E-02 -.21231572E-05 .38208343E-09 -.25807090E-13
-.94398334E+05 -.26018757E+02 .21192445E+01 .31545710E-01 -.31317888E-04
.12461507E-07 -.82514630E-12 -.92361596E+05 .15546442E+02
H2 J 3/77H 2. 0. 0. 0.G 300.000 5000.000
.30558123E+01 .59740400E-03 -.16747471E-08 -.21247544E-10 .25195487E-14
-.86168476E+03 -.17207073E+01 .29432327E+01 .34815509E-02 -.77713819E-05
.74997496E-08 -.25203379E-11 -.97695413E+03 -.18186137E+01
H2O(S) L11/65H 2.O 1.00 0.00 0.S 200.000 273.150
.00000000 .00000000 .00000000 .00000000 .00000000
.00000000 .00000000 -.39269330E-01 .16920420E-01 .00000000
.00000000 .00000000 -.35949581E+05 .56933784E+00
H2O(L) L11/65H 2.O 1.00 0.00 0.L 273.150 1000.000
.00000000 .00000000 .00000000 .00000000 .00000000
.00000000 .00000000 .12712782E+02 -.17662790E-01 -.22556661E-04
.20820908E-06 -.24078614E-09 -.37483200E+05 -.59115345E+02
H2O J 3/61H 2.O 1.00 0.00 0.G 300.000 5000.000
.27167633E+01 .29451374E-02 -.80224374E-06 .10226682E-09 -.48472145E-14
-.29905826E+05 .66305671E+01 .40701275E+01 -.11084499E-02 .41521180E-05
-.29637404E-08 .80702103E-12 -.30279722E+05 -.32270046E+00
H2O2 L 2/69H 2.O 2.0 0.0 0.G 300.000 5000.000
.45731667E+01 .43361363E-02 -.14746888E-05 .23489037E-09 -.14316536E-13
-.18006961E+05 .50113696E+00 .33887536E+01 .65692260E-02 -.14850126E-06
-.46258055E-08 .24715147E-11 -.17663147E+05 .67853631E+01
H2S J12/65H 2.S 1.00 0.00 0.G 300.000 5000.000
.28479103E+01 .38415990E-02 -.14099367E-05 .24278754E-09 -.15783283E-13
-.34469788E+04 .74781412E+01 .38811293E+01 -.13211856E-03 .36517726E-05
-.21820445E-08 .28783779E-12 -.36350917E+04 .25161511E+01
H2SO4(L) J12/66H 2.S 1.O 4. 0.L 300.000 2000.000
.19537798E+02 .22764318E-02 -.46662669E-08 -.83314872E-09 .24879731E-12
-.10441888E+06 -.94525698E+02 .64979802E+01 .52939960E-01 -.76283829E-04
.51075960E-07 -.13004852E-10 -.10161098E+06 -.30963395E+02
H2SO4 J12/66H 2.S 1.O 4. 0.G 300.000 5000.000
.10893733E+02 .73577938E-02 -.27934016E-05 .48889853E-09 -.32326917E-13
-.93185848E+05 -.30424431E+02 .10093716E+01 .39770886E-01 -.40434356E-04
.17110582E-07 -.15417850E-11 -.90814577E+05 .19098505E+02
H3B3O6 J12/64H 3.B 3.O 6.00 0.G 300.000 5000.000
.20153579E+02 .13016286E-01 -.50669619E-05 .90308253E-09 -.60532410E-13
-.28104092E+06 -.79689531E+02 -.22705116E+01 .87024894E-01 -.91587714E-04
.39445392E-07 -.36666035E-11 -.27569523E+06 .32516454E+02
N J 3/77N 1. 0. 0. 0.G 300.000 5000.000
.24370811E+01 .13233886E-03 -.90907754E-07 .22864054E-10 -.13762291E-14
.56128585E+05 .45211111E+01 .25000004E+01 -.31078154E-08 .83216097E-11
-.94278278E-14 .38108039E-17 .56106975E+05 .41806431E+01
N+ J 3/77N 1.E -1. 0. 0.G 300.000 5000.000
.24967940E+01 .31252246E-04 -.33618729E-07 .11713948E-10 -.10312857E-14
.22563627E+06 .49930418E+01 .27903242E+01 -.13627563E-02 .25659418E-05
-.21911714E-08 .70277201E-12 .22558318E+06 .36179803E+01
N- J 3/77N 1.E 1. 0. 0.G 300.000 5000.000
.25093227E+01 -.10571985E-04 .46391470E-08 -.89788329E-12 .63932728E-16
.56208578E+05 .49344823E+01 .26200113E+01 -.54322768E-03 .99735826E-06
-.83545659E-09 .26387064E-12 .56189188E+05 .44184034E+01
NCO J12/70N 1.C 1.O 1.0 0.G 300.000 5000.000
.49964357E+01 .26250880E-02 -.10928387E-05 .20309111E-09 -.13915195E-13
.17379356E+05 -.17325320E+01 .31092021E+01 .66201022E-02 -.26070086E-05
-.14966380E-08 .10922032E-11 .17977514E+05 .83561334E+01
NF J 6/65N 1.F 1.00 0.00 0.G 300.000 5000.000
.38624046E+01 .74409961E-03 -.29304178E-06 .55130022E-10 -.38317928E-14
.28669390E+05 .34570237E+01 .30480680E+01 .19566867E-02 .94322448E-06
-.29336643E-08 .13504454E-11 .28941688E+05 .79092363E+01
NF2 J 3/64N 1.F 2.00 0.00 0.G 300.000 5000.000
.57186890E+01 .14102822E-02 -.60493969E-06 .11491911E-09 -.80536431E-14
.30992968E+04 -.34469259E+01 .25009872E+01 .10721062E-01 -.92064150E-05
.19027666E-08 .71249647E-12 .39376954E+04 .12994042E+02
NF3 J 6/69N 1.F 3.0 0.0 0.G 300.000 5000.000
.79819180E+01 .22349897E-02 -.96301027E-06 .18357806E-09 -.12901442E-13
-.18673358E+05 -.15667394E+02 .12676904E+01 .24289231E-01 -.26835971E-04
.11994191E-07 -.12905657E-11 -.17059051E+05 .17977633E+02
NH J12/71N 1.H 1. 0. 0.G 300.000 5000.000
.27789900E+01 .13266349E-02 -.41101218E-06 .69414505E-10 -.44536190E-14
.44567973E+05 .57593434E+01 .34938318E+01 .24529034E-03 -.12578521E-05
.22011922E-08 -.92288834E-12 .44326826E+05 .18451723E+01
NH2 J12/65N 1.H 2.00 0.00 0.G 300.000 5000.000
.25769524E+01 .35896090E-02 -.12276328E-05 .19549576E-09 -.11873401E-13
.19335912E+05 .79074890E+01 .40385791E+01 -.10098163E-02 .40120903E-05
-.23085312E-08 .39022887E-12 .18973010E+05 .52464285E+00
NH3 J 9/65N 1.H 3.00 0.00 0.G 300.000 5000.000
.24165177E+01 .61871211E-02 -.21785136E-05 .37599090E-09 -.24448856E-13
-.64747177E+04 .77043482E+01 .35912768E+01 .49388668E-03 .83449322E-05
-.83833385E-08 .27299092E-11 -.66717143E+04 .22520966E+01
NO J 6/63N 1.O 1.00 0.00 0.G 300.000 5000.000
.31890000E+01 .13382281E-02 -.52899318E-06 .95919332E-10 -.64847932E-14
.98283290E+04 .67458126E+01 .40459521E+01 -.34181783E-02 .79819190E-05
-.61139316E-08 .15919076E-11 .97453934E+04 .29974988E+01
NO+ J 6/66N 1.O 1.E -1.00 0.G 300.000 5000.000
.28885488E+01 .15217119E-02 -.57531241E-06 .10051081E-09 -.66044294E-14
.11819245E+06 .70027197E+01 .36685056E+01 -.11544580E-02 .21755608E-05
-.48227472E-09 -.27847906E-12 .11803369E+06 .31779324E+01
NOCL J12/72N 1.O 1.CL 1. 0.G 300.000 5000.000
.54178186E+01 .17391415E-02 -.67354352E-06 .12747721E-09 -.88128378E-14
.44207903E+04 -.15287316E+00 .40453848E+01 .58322333E-02 -.54789276E-05
.27968775E-08 -.59348675E-12 .47980577E+04 .68935321E+01
NOF J 6/61N 1.O 1.F 1.00 0.G 300.000 5000.000
.51906666E+01 .18924266E-02 -.78642361E-06 .14626364E-09 -.10097419E-13
-.96758164E+04 -.62298477E+00 .32902070E+01 .74045493E-02 -.66195803E-05
.26529282E-08 -.29526815E-12 -.91566645E+04 .91451185E+01
NOF3 J 6/70N 1.O 1.F 3.0 0.G 300.000 5000.000
.98929009E+01 .33819898E-02 -.14438138E-05 .27381685E-09 -.19186406E-13
-.23185488E+05 -.24944299E+02 .14275875E+01 .32431849E-01 -.38573384E-04
.20510613E-07 -.37109560E-11 -.21189425E+05 .17224286E+02
NO2 J 9/64N 1.O 2.00 0.00 0.G 300.000 5000.000
.46240771E+01 .25260332E-02 -.10609498E-05 .19879239E-09 -.13799384E-13
.22899900E+04 .13324138E+01 .34589236E+01 .20647064E-02 .66866067E-05
-.95556725E-08 .36195881E-11 .28152265E+04 .83116983E+01
NO2- J 6/72N 1.O 2.E 1. 0.G 300.000 5000.000
.50160903E+01 .21884463E-02 -.94586144E-06 .17939789E-09 -.12052428E-13
-.26200160E+05 -.12861447E+01 .29818036E+01 .49398681E-02 .28557293E-05
-.78905297E-08 .35391483E-11 -.25501540E+05 .99161680E+01
NO2CL J12/65N 1.O 2.CL 1.00 0.G 300.000 5000.000
.72062138E+01 .29949809E-02 -.12641260E-05 .23758750E-09 -.16524848E-13
-.11366123E+04 -.99256667E+01 .30302225E+01 .14538930E-01 -.11645930E-04
.25890139E-08 .64589481E-12 .76652034E+01 .11618599E+02
NO2F J12/65N 1.O 2.F 1.00 0.G 300.000 5000.000
.68639166E+01 .33554437E-02 -.14158297E-05 .26622227E-09 -.18531606E-13
-.15621287E+05 -.95806218E+01 .22424380E+01 .16289716E-01 -.13344332E-04
.32719525E-08 .59144703E-12 -.14364205E+05 .14218996E+02
NO3 J12/64N 1.O 3. 0. 0.G 300.000 5000.000
.72033289E+01 .30908791E-02 -.13329045E-05 .25461601E-09 -.17939047E-13
.58244016E+04 -.12608119E+02 .76867377E+00 .21181075E-01 -.16980256E-04
.22963836E-08 .19321041E-11 .75292921E+04 .20406284E+02
N2 J 3/77N 2. 0. 0. 0.G 300.000 5000.000
.28532899E+01 .16022128E-02 -.62936893E-06 .11441022E-09 -.78057465E-14
-.89008093E+03 .63964897E+01 .37044177E+01 -.14218753E-02 .28670392E-05
-.12028885E-08 -.13954677E-13 -.10640795E+04 .22336285E+01
N2H4 J12/65N 2.H 4.00 0.00 0.G 300.000 5000.000
.50947770E+01 .93296138E-02 -.33626986E-05 .56308304E-09 -.35859661E-13
.92996644E+04 -.35950952E+01 .79803836E+00 .21788097E-01 -.13456754E-04
-.12698753E-09 .25865213E-11 .10379887E+05 .18248696E+02
N2O J12/64N 2.O 1.00 0.00 0.G 300.000 5000.000
.47306679E+01 .28258267E-02 -.11558115E-05 .21263683E-09 -.14564087E-13
.81617682E+04 -.17151073E+01 .26189196E+01 .86439616E-02 -.68110624E-05
.22275877E-08 -.80650330E-13 .87590123E+04 .92266952E+01
N2O+ J12/70N 2.O 1.E -1.0 0.G 300.000 5000.000
.53926946E+01 .22337196E-02 -.93548832E-06 .17466166E-09 -.12059043E-13
.15847633E+06 -.36920186E+01 .34273064E+01 .63787690E-02 -.22585149E-05
-.20421800E-08 .13481477E-11 .15909237E+06 .67997616E+01
N2O4 J 9/64N 2.O 4.00 0.00 0.G 300.000 5000.000
.10506637E+02 .58723267E-02 -.24766296E-05 .46556024E-09 -.32402082E-13
-.28609096E+04 -.26252230E+02 .36662865E+01 .23491748E-01 -.16007297E-04
.11845939E-08 .20001618E-11 -.90631797E+03 .93973337E+01
N2O5 J12/64N 2.O 5. 0. 0.G 300.000 5000.000
.14413736E+02 .40494080E-02 -.17661640E-05 .33912224E-09 -.23926356E-13
-.38366062E+04 -.43313433E+02 .32144535E+01 .37992511E-01 -.36847600E-04
.12409293E-07 .24351911E-12 -.98609506E+03 .13555831E+02
N3 J12/70N 3.0 0.0 0.0 0.G 300.000 5000.000
.51996828E+01 .24335678E-02 -.10192340E-05 .19062350E-09 -.13212412E-13
.47963131E+05 -.35547759E+01 .30624389E+01 .73590658E-02 -.38229374E-05
-.71824202E-09 .91110236E-12 .48614547E+05 .77570129E+01
O J 3/77O 1. 0. 0. 0.G 300.000 5000.000
.25342961E+01 -.12478170E-04 -.12562724E-07 .69029862E-11 -.63797095E-15
.29231108E+05 .49628591E+01 .30309401E+01 -.22525853E-02 .39824540E-05
-.32604921E-08 .10152035E-11 .29136526E+05 .26099342E+01
O+ J 3/77O 1.E -1. 0. 0.G 300.000 5000.000
.25016589E+01 -.59563416E-05 .71194526E-08 -.33646595E-11 .54268097E-15
.18793969E+06 .43720399E+01 .25000004E+01 -.31078073E-08 .83215893E-11
-.94278063E-14 .38107959E-17 .18794001E+06 .43801149E+01
O- J 3/77O 1.E 1. 0. 0.G 300.000 5000.000
.25494971E+01 -.56262531E-04 .24902683E-07 -.48702865E-11 .35042005E-15
.11493119E+05 .44820553E+01 .29002546E+01 -.16354106E-02 .28202166E-05
-.22688058E-08 .69736252E-12 .11426745E+05 .28209917E+01
OH J12/70O 1.H 1.0 0.0 0.G 300.000 5000.000
.29131230E+01 .95418248E-03 -.19084325E-06 .12730795E-10 .24803941E-15
.39647060E+04 .54288735E+01 .38365518E+01 -.10702014E-02 .94849757E-06
.20843575E-09 -.23384265E-12 .36715807E+04 .49805456E+00
OH+ J12/70O 1.H 1.E -1.0 0.G 300.000 5000.000
.27381495E+01 .14613173E-02 -.46950536E-06 .73663560E-10 -.41410922E-14
.15761683E+06 .61343811E+01 .35365969E+01 -.47029254E-04 -.62344259E-06
.17601461E-08 -.82678699E-12 .15736677E+06 .18477172E+01
OH- J12/70O 1.H 1.E 1.0 0.G 300.000 5000.000
.28881148E+01 .96560229E-03 -.19659254E-06 .14053802E-10 .12080617E-15
-.18086455E+05 .41896259E+01 .34621427E+01 .40525802E-03 -.13516992E-05
.17899459E-08 -.63434810E-12 -.18312355E+05 .92893220E+00
O2 J 3/77O 2. 0. 0. 0.G 300.000 5000.000
.36122139E+01 .74853166E-03 -.19820647E-06 .33749008E-10 -.23907374E-14
-.11978151E+04 .36703307E+01 .37837135E+01 -.30233634E-02 .99492751E-05
-.98189101E-08 .33031825E-11 -.10638107E+04 .36416345E+01
O2- J12/66O 2.E 1.00 0.00 0.G 300.000 5000.000
.38147234E+01 .77444546E-03 -.30677649E-06 .56618118E-10 -.38229492E-14
-.69910087E+04 .29587995E+01 .31440525E+01 .12127972E-02 .23812161E-05
-.40914092E-08 .16885304E-11 -.67369752E+04 .67688687E+01
O3 J 6/61O 3.0 0.0 0.0 0.G 300.000 5000.000
.54665239E+01 .17326031E-02 -.72204889E-06 .13721660E-09 -.96233828E-14
.15214096E+05 -.34712616E+01 .24660617E+01 .91703209E-02 -.49698480E-05
-.20634230E-08 .20015595E-11 .16059556E+05 .12172130E+02
C3H8 C 3.H 8. 0. 0.G 300.000 1500.000
.42948342E+01 .19538024E-01 .32109452E-05 -.84809778E-08 .24872618E-11
-.14850966E+05 .16012209E+01 .74188008E+00 .26778804E-01 .78425850E-05
-.25901330E-07 .11588147E-10 -.13927371E+05 .20119121E+02
C6H6 L 4/69C 6.H 6. 0. 0.G 300.000 1000.000
.00000000 .00000000 .00000000 .00000000 .00000000
.00000000 .00000000 -.36592434E+01 .50995987E-01 -.14417162E-04
-.20338971E-07 .12665048E-10 .89598009E+04 .38817831E+02
C6H6(L) L 4/69C 6.H 6. 0. 0.L 300.000 1000.000
-.15107840E+01 .53738751E-01 .20903744E-04 .00000000 .00000000
.37755265E+04 .12488106E+02 -.15107840E+01 .53738751E-01 .20903744E-04
.00000000 .00000000 .37755265E+04 .12488106E+02
C7H8 C 7.H 8. 0. 0.G 300.000 1500.000
-.98056097E+01 .41766033E-01 .41713254E-04 -.61631624E-07 .19253585E-10
.92693711E+04 .85754852E+02 -.20565853E+01 .51095083E-01 .23094590E-05
-.39232358E-07 .19180060E-10 .44053164E+04 .35151306E+02
C7H16 X10/85C 7.H 16. 0. 0.G 300.000 5000.000
1.185354704E+01 3.91420468E-02 -1.38030268E-05 2.22403874E-09 -1.33452580E-13
-3.19500783E+01 -7.01902840E+01 1.11532484E+01 -9.49476433E-03 1.95571181E-04
-0.49752520E-07 9.84873213E-11 -2.67711735E+04 -1.59096110E+01
C8H16 L 9/74C 8.H 16. 0. 0.G 300.000 1500.000
-.19137314E+02 .69371462E-01 .67576038E-04 -.10115679E-06 .31757513E-10
-.29994805E+04 .15213559E+03 .27015257E+01 .63744605E-01 .10288634E-04
-.51851664E-07 .23527721E-10 -.13609438E+05 .21171082E+02
C8H18 L 4/69C 8.H 18. 0. 0.G 300.000 1000.000
.00000000 .00000000 .00000000 .00000000 .00000000
.00000000 .00000000 .21142864E+01 .80824231E-01 -.31247369E-04
.00000000 .00000000 -.29011939E+05 .21016129E+02
C8H18(L) L 4/69C 8.H 18. 0. 0.L 300.000 1000.000
-.84282634E+02 .79481841E+00 -.13738980E-02 .00000000 .00000000
-.28129138E+05 .34774181E+03 -.84282634E+02 .79481841E+00 -.13738980E-02
.00000000 .00000000 -.28129138E+05 .34774181E+03
C12H26 L 4/69C 12.H 26. 0. 0.G 300.000 1000.000
.00000000 .00000000 .00000000 .00000000 .00000000
.00000000 .00000000 .35890940E+01 .11929898E+00 -.46546312E-04
.00000000 .00000000 -.40949233E+05 .20296207E+02
C2H5OH L12/73C 2.H 6.O 1. 0.G 300.000 1000.000
.00000000 .00000000 .00000000 .00000000 .00000000
.00000000 .00000000 .20453260E+01 .18097289E-01 .11356807E-04
-.25318665E-07 .10843493E-10 -.29665177E+05 .16637635E+02
C3H8() L12/73C 3.H 8.O 1. 0.G 300.000 1000.000
.00000000 .00000000 .00000000 .00000000 .00000000
.00000000 .00000000 .28935102E+01 .22546234E-01 .18912669E-04
-.35990505E-07 .14751417E-10 -.32800045E+05 .15191566E+02
C4H 121686C 4.H 1. 0. 0.G 300.000 5000.00
6.24288178E+0 6.19368255E-3 -2.08593156E-6 3.08220338E-10 -1.63648256E-14
7.56801875E+4 -7.21080589E+0 5.02324677E+0 7.09237531E-3 -6.07376194E-9
-2.27575225E-9 8.08699407E-13 7.62381250E+4 -6.94259405E-2
C4H2 121686C 4.H 2. 0. 0.G 300.000 5000.00
9.03140736E+0 6.04725257E-3 -1.94878885E-6 2.75486300E-10 -1.38560801E-14
5.29473555E+4 -2.38506775E+1 4.00519180E+0 1.98100023E-2 -9.86587747E-6
-6.63515820E-9 6.07741288E-12 5.42406484E+4 1.84573650E+0
C4H3 121686C 4.H 3. 0. 0.G 300.000 5000.00
8.48742008E+0 8.69089365E-3 -2.85444367E-6 4.12007983E-10 -2.13010931E-14
4.79705547E+4 -1.90185089E+1 3.55397129E+0 1.94619857E-2 -4.81024836E-6
-9.73012249E-9 6.23905355E-12 4.94538633E+4 7.08298683E+0
C4H4 121686C 4.H 4. 0. 0.G 300.00 5000.00
8.89214897E+0 1.09088495E-2 -3.59495971E-6 5.19341903E-10 -2.68089214E-14
3.32843477E+4 -2.17269440E+1 2.14033699E+0 2.46050470E-2 -3.63916570E-6
-1.53040141E-8 8.89646083E-12 3.53740000E+4 1.42824774E+1
C4H6 120186C 4.H 6. 0. 0.G 300.00 5000.00
8.04658318E+0 1.64852515E-2 -5.52222718E-6 8.12359291E-10 -4.29507843E-14
1.37013047E+4 -1.80045776E+1 3.19710827E+0 2.02559158E-2 6.51019218E-6
-1.65844227E-8 6.40028221E-12 1.57152031E+4 9.89566040E+0
C4H8 120386C 4.H 8. 0. 0.G 300.00 5000.00
2.05358410E+0 3.43505070E-2 -1.58831972E-5 3.30896621E-9 -2.53610447E-13
-2.13972315E+3 1.55432015E+1 1.18113804E+0 3.08533795E-2 5.08652465E-6
-2.46548879E-8 1.11101926E-11 -1.79040039E+3 2.10624695E+1
C4H7 AG87 C 4.H 7. 0. 0.G 300.000 5000.000
0.46138570E+1 0.25610800E-1 -.10544010E-4 0.19418000E-8 -.13167620E-12
-.26730190E+4 0.15504400E+1 0.68388910E+1 0.21225990E-3 0.53886070E-4
-.57184410E-7 0.17736180E-10 -.24199150E+4 -.53194760E+1
H8C4 KEINVC 4.H 8. 0. 0.G 300.00 5000.00
2.05358410E+0 3.43505070E-2 -1.58831972E-5 3.30896621E-9 -2.53610447E-13
-2.13972315E+3 1.55432015E+1 1.18113804E+0 3.08533795E-2 5.08652465E-6
-2.46548879E-8 1.11101926E-11 -1.79040039E+3 2.10624695E+1
C4H9 WARNZ C 4.H 9. 0. 0.G 300.000 5000.000
0.93805494E+1 0.10011688E-1 -.30188721E-5 0.36665226E-9 -.12681418E-13
0.33139949E+5 -.24441711E+2 0.32948971E+1 0.20137779E-1 0.77487982E-7
-.13250023E-7 0.64672590E-11 0.35238629E+5 0.88411312E+1
H9C4 WARNZ C 4.H 9. 0. 0.G 300.000 5000.000
0.77541008E+1 0.23770157E-1 -.80376340E-5 0.11938439E-8 -.63866501E-13
0.74535205E+3 -.15286139E+2 0.14004288E+1 0.24845254E-1 0.15668920E-4
-.25635558E-7 0.83376197E-11 0.36863530E+4 0.22517868E+2
C4H10 WARNZ C 4.H 10. 0. 0.G 300.000 5000.000
0.10668672E+2 0.23357686E-1 -.77434970E-5 0.11380079E-8 -.60307445E-13
-.20635121E+5 -.33023392E+2 0.31141586E+1 0.28759062E-1 0.10943818E-4
-.24285349E-7 0.88289480E-11 -.17432398E+5 0.10668451E+2
C4H2O C 4.H 2.O 1. 0.G 300.000 5000.000
0.18250000E+1 0.03130000E+0 -.22500000E-4 0.58900000E-8 0.00000000
-.27053000E+5 0.58300000E+1 0.18250000E+1 0.03130000E+0 -.22500000E-4
0.58900000E-8 0.00000000 -.27053000E+5 0.58300000E+1
C5H 20387C 5.H 1. 0. 0.G 300.00 5000.00
8.69574928E+0 6.05430082E-3 -2.01601051E-6 2.89289259E-10 -1.47009954E-14
9.03106875E+4 -2.10159454E+1 1.63482475E+0 2.50953808E-2 -1.20663644E-5
-1.04651106E-8 8.80998833E-12 9.21248750E+4 1.51219368E+1
C5H12 20387C 5.H 12. 0. 0.G 300.00 4000.00
1.66779785E+1 2.11448297E-2 -3.53332143E-6 -5.74220227E-10 1.51594828E-13
-2.55366992E+4 -6.37294006E+1 1.87790775E+0 4.12164554E-2 1.25323368E-5
-3.70153686E-8 1.52556856E-11 -2.00381563E+4 1.87725678E+1
C5H2 20587C 5.H 2. 0. 0.G 300.00 5000.00
1.13291750E+1 7.42405653E-3 -2.62818867E-6 4.08254097E-10 -2.30133261E-14
7.87870625E+4 -3.61711731E+1 3.06232166E+0 2.70999819E-2 -1.00916968E-5
-1.27274511E-8 9.16721907E-12 8.11496875E+4 7.07107830E+0
C5H3 20387C 5.H 3. 0. 0.G 300.00 5000.00
1.07876225E+1 9.53961909E-3 -3.20674462E-6 4.73332262E-10 -2.51213540E-14
6.39290430E+4 -3.00544434E+1 4.32872009E+0 2.35248022E-2 -5.85672296E-6
-1.21544943E-8 7.72647831E-12 6.58853125E+4 4.17325878E+0
C5H6 20387C 5.H 6. 0. 0.G 300.00 5000.00
9.68981457E+0 1.83826201E-2 -6.26488418E-6 9.39337719E-10 -5.08770814E-14
1.10212422E+4 -3.12290802E+1 -3.19673920E+0 4.08136100E-2 6.81650533E-7
-3.13745900E-8 1.57722307E-11 1.52906758E+4 3.86993866E+1
CH3OH J 3/61C 1.H 4.O 1.0 0.G 300.000 5000.000
.38460000E+01 .00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00
-.24151000E+06 .00000000E+00 .38460000E+01 .00000000E+00 .00000000E+00
.00000000E+00 .00000000E+00 -.24151000E+06 .00000000E+00
CH3O J 3/61C 1.H 3.O 1.0 0.G 300.000 5000.000
.37260000E+01 .00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00
.19610000E+04 .00000000E+00 .37260000E+01 .00000000E+00 .00000000E+00
.00000000E+00 .00000000E+00 .19610000E+04 .00000000E+00
CHO J 3/61C 1.H 1.O 1.0 0.G 300.000 5000.000
.34850000E+01 .00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00
.50480000E+04 .00000000E+00 .34850000E+01 .00000000E+00 .00000000E+00
.00000000E+00 .00000000E+00 .50480000E+04 .00000000E+00
Fulven J 3/61C 1.H 4.O 1.0 0.G 300.000 5000.000
.00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00
.00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00
.00000000E+00 .00000000E+00 .00000000E+00 .00000000E+00
uCH2 J12/72C 1.H 2. 0. 0.G 300.000 5000.000
.27525479E+01 .39782047E-02 -.14921731E-05 .25956899E-09 -.17110673E-13
.45547759E+05 .66534799E+01 .35883347E+01 .21724137E-02 -.13323408E-05
.19469445E-08 -.89431394E-12 .45315188E+05 .22627869E+01
tCH2 J12/72C 1.H 2. 0. 0.G 300.000 5000.000
.27525479E+01 .39782047E-02 -.14921731E-05 .25956899E-09 -.17110673E-13
.45547759E+05 .66534799E+01 .35883347E+01 .21724137E-02 -.13323408E-05
.19469445E-08 -.89431394E-12 .45315188E+05 .22627869E+01
SO2 CO2_modifie S 1.O 2.00 0.00 0.G 300.000 5000.000
.44608041E+01 .30981719E-02 -.12392571E-05 .22741325E-09 -.15525954E-13
-.48961442E+05 -.98635982E+00 .24007797E+01 .87350957E-02 -.66070878E-05
.20021861E-08 .63274039E-15 -.48377527E+05 .96951457E+01
END 0. 0. 0. 0. .000 .000
LAST
|
