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
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LSD
WLViewer 3D 0
49 52 0 0 0 0 0 0 0 0 0
-2.6970 -1.2710 1.4370 C 0 0 0 0 0 0 0 0 0 1
-2.1260 -0.7170 0.2820 C 0 0 0 0 0 0 0 0 0 2
-3.0210 -0.2340 -0.7080 C 0 0 0 0 0 0 0 0 0 3
-4.4130 -0.4280 -0.5560 C 0 0 0 0 0 0 0 0 0 4
-4.9490 -1.1190 0.5540 C 0 0 0 0 0 0 0 0 0 5
-4.0590 -1.5160 1.5530 C 0 0 0 0 0 0 0 0 0 6
-4.2410 -2.4710 2.4970 N 0 0 0 0 0 0 0 0 0 7
-3.0360 -2.8570 2.9600 C 0 0 0 0 0 0 0 0 0 8
-2.0370 -2.1060 2.3260 C 0 0 0 0 0 0 0 0 0 9
-0.6150 -2.5770 1.9770 C 0 0 0 0 0 0 0 0 0 10
0.1190 -1.4210 1.2820 C 0 0 0 0 0 0 0 0 0 11
-0.7100 -0.7530 0.1620 C 0 0 0 0 0 0 0 0 0 12
0.3000 -0.6390 2.0940 H 0 0 0 0 0 0 0 0 0 13
1.3880 -1.9140 0.7490 N 0 0 0 0 0 0 0 0 0 14
-0.0130 -0.1140 -0.8760 C 0 0 0 0 0 0 0 0 0 15
1.5190 -0.0620 -0.9210 C 0 0 0 0 0 0 0 0 0 16
2.1880 -0.7660 0.2680 C 0 0 0 0 0 0 0 0 0 17
1.8520 -0.5990 -1.8460 H 0 0 0 0 0 0 0 0 0 18
1.9720 1.3980 -0.9460 C 0 0 0 0 0 0 0 0 0 19
1.2270 2.3090 -0.2520 O 0 0 0 0 0 0 0 0 0 20
3.3460 1.7350 -1.3420 N 0 0 0 0 0 0 0 0 0 21
3.7540 3.0600 -0.7810 C 0 0 0 0 0 0 0 0 0 22
5.2140 3.4120 -1.0480 C 0 0 0 0 0 0 0 0 0 21
3.5380 1.6300 -2.8220 C 0 0 0 0 0 0 0 0 0 24
4.8480 0.9230 -3.1490 C 0 0 0 0 0 0 0 0 0 25
-2.6610 0.2240 -1.6170 H 0 0 0 0 0 0 0 0 0 26
-5.0341 -0.0671 -1.2516 H 0 0 0 0 0 0 0 0 0 27
-5.9272 -1.3157 0.6210 H 0 0 0 0 0 0 0 0 0 28
-5.1440 -3.0550 2.6310 H 0 0 0 0 0 0 0 0 0 29
-2.8794 -3.5667 3.6469 H 0 0 0 0 0 0 0 0 0 30
-0.7010 -3.4420 1.3160 H 0 0 0 0 0 0 0 0 0 31
-0.1100 -2.8840 2.8980 H 0 0 0 0 0 0 0 0 0 32
-0.5580 0.3960 -1.6510 H 0 0 0 0 0 0 0 0 0 33
2.3200 -0.0640 1.0920 H 0 0 0 0 0 0 0 0 0 34
3.1790 -1.1150 -0.0350 H 0 0 0 0 0 0 0 0 0 35
3.5900 3.0430 0.2890 H 0 0 0 0 0 0 0 0 0 36
3.1150 3.8330 -1.2140 H 0 0 0 0 0 0 0 0 0 37
5.3700 3.6180 -2.1670 H 0 0 0 0 0 0 0 0 0 38
5.8880 2.5660 -0.7040 H 0 0 0 0 0 0 0 0 0 39
5.4820 4.3880 -0.4470 H 0 0 0 0 0 0 0 0 0 40
3.5150 2.6320 -3.2510 H 0 0 0 0 0 0 0 0 0 41
2.7130 1.0850 -3.2580 H 0 0 0 0 0 0 0 0 0 42
4.8720 -0.1060 -2.6440 H 0 0 0 0 0 0 0 0 0 43
5.7500 1.5500 -2.7900 H 0 0 0 0 0 0 0 0 0 44
4.9220 0.7870 -4.3200 H 0 0 0 0 0 0 0 0 0 45
1.6900 -3.4030 0.7590 C 0 0 0 0 0 0 0 0 0 46
0.9360 -3.9310 0.1740 H 0 0 0 0 0 0 0 0 0 47
1.6750 -3.7700 1.7860 H 0 0 0 0 0 0 0 0 0 48
2.6740 -3.5780 0.3250 H 0 0 0 0 0 0 0 0 0 49
1 2 1 0 0 0
1 6 2 0 0 0
1 9 1 0 0 0
2 12 1 0 0 0
2 3 2 0 0 0
3 4 1 0 0 0
3 26 1 0 0 0
4 27 1 0 0 0
4 5 2 0 0 0
5 6 1 0 0 0
5 28 1 0 0 0
6 7 1 0 0 0
7 29 1 0 0 0
7 8 1 0 0 0
8 9 2 0 0 0
8 30 1 0 0 0
9 10 1 0 0 0
10 32 1 0 0 0
10 11 1 0 0 0
10 31 1 0 0 0
11 12 1 0 0 0
11 14 1 0 0 0
11 13 1 0 0 0
12 15 2 0 0 0
14 46 1 0 0 0
14 17 1 0 0 0
15 16 1 0 0 0
15 33 1 0 0 0
16 19 1 0 0 0
16 18 1 0 0 0
16 17 1 0 0 0
17 34 1 0 0 0
17 35 1 0 0 0
19 21 1 0 0 0
19 20 2 0 0 0
21 22 1 0 0 0
21 24 1 0 0 0
22 23 1 0 0 0
22 37 1 0 0 0
22 36 1 0 0 0
23 39 1 0 0 0
23 40 1 0 0 0
23 38 1 0 0 0
24 42 1 0 0 0
24 25 1 0 0 0
24 41 1 0 0 0
25 44 1 0 0 0
25 43 1 0 0 0
25 45 1 0 0 0
46 47 1 0 0 0
46 49 1 0 0 0
46 48 1 0 0 0
M END
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