File: MOL_00004.mol

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file content (116 lines) | stat: -rw-r--r-- 3,230 bytes parent folder | download | duplicates (4)
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  ChemDraw01112316112D

  0  0  0     0  0              0 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 49 55 0 0 0
M  V30 BEGIN ATOM
M  V30 1 Cl 1.091393 1.424893 0.000000 0 CHG=-1
M  V30 2 Pd 0.376898 1.837390 0.000000 0 CHG=2
M  V30 3 P 0.376898 0.517398 0.000000 0
M  V30 4 C 1.201893 0.517398 0.000000 0
M  V30 5 C 1.614391 1.231794 0.000000 0
M  V30 6 C 2.439386 1.231794 0.000000 0
M  V30 7 C 2.851885 0.517398 0.000000 0
M  V30 8 C 2.439386 -0.197099 0.000000 0
M  V30 9 C 1.614391 -0.197099 0.000000 0
M  V30 10 C 0.491997 -0.797595 0.000000 0
M  V30 11 C 1.288792 -0.584097 0.000000 0
M  V30 12 C 1.872189 -1.167493 0.000000 0
M  V30 13 C 1.658690 -1.964289 0.000000 0
M  V30 14 C 0.861796 -2.177888 0.000000 0
M  V30 15 C 0.278399 -1.594491 0.000000 0
M  V30 16 C -0.304898 -2.177888 0.000000 0
M  V30 17 C -0.091400 -2.974784 0.000000 0
M  V30 18 C 0.705496 -3.188284 0.000000 0
M  V30 19 C 1.288792 -2.604886 0.000000 0
M  V30 20 C 0.918995 -3.985178 0.000000 0
M  V30 21 C -0.674797 -3.558081 0.000000 0
M  V30 22 C -1.471693 -3.344582 0.000000 0
M  V30 23 C -2.054990 -3.927979 0.000000 0
M  V30 24 C -2.851885 -3.714380 0.000000 0
M  V30 25 C -1.841491 -4.724874 0.000000 0
M  V30 26 C -1.685191 -2.547687 0.000000 0
M  V30 27 C -1.101795 -1.964289 0.000000 0
M  V30 28 C -1.450493 -1.216593 0.000000 0
M  V30 29 C -2.272289 -1.144694 0.000000 0
M  V30 30 C -0.977295 -0.540797 0.000000 0
M  V30 31 C -0.444998 0.589297 0.000000 0
M  V30 32 C -0.918196 -0.086499 0.000000 0
M  V30 33 C -1.739991 -0.014600 0.000000 0
M  V30 34 C -2.088690 0.733096 0.000000 0
M  V30 35 C -1.615492 1.408893 0.000000 0
M  V30 36 C -0.793596 1.336993 0.000000 0
M  V30 37 C -0.337599 2.249888 0.000000 0 CHG=-1
M  V30 38 C -1.051995 1.837390 0.000000 0
M  V30 39 C -1.766491 2.249888 0.000000 0
M  V30 40 C -1.766491 3.074884 0.000000 0
M  V30 41 C -1.051995 3.487382 0.000000 0
M  V30 42 C -0.337599 3.074884 0.000000 0
M  V30 43 C 0.376898 3.487382 0.000000 0
M  V30 44 C 0.376898 4.312378 0.000000 0
M  V30 45 C 1.091393 4.724874 0.000000 0
M  V30 46 C 1.805890 4.312378 0.000000 0
M  V30 47 C 1.805890 3.487382 0.000000 0
M  V30 48 C 1.091393 3.074884 0.000000 0
M  V30 49 N 1.091393 2.249888 0.000000 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 9 1 2
M  V30 2 9 3 2
M  V30 3 1 3 4
M  V30 4 1 4 5
M  V30 5 1 5 6
M  V30 6 1 6 7
M  V30 7 1 7 8
M  V30 8 1 8 9
M  V30 9 1 4 9
M  V30 10 1 3 10
M  V30 11 2 10 11
M  V30 12 1 11 12
M  V30 13 2 12 13
M  V30 14 1 13 14
M  V30 15 2 14 15
M  V30 16 1 10 15
M  V30 17 1 15 16
M  V30 18 2 16 17
M  V30 19 1 17 18
M  V30 20 1 18 19
M  V30 21 1 18 20
M  V30 22 1 17 21
M  V30 23 2 21 22
M  V30 24 1 22 23
M  V30 25 1 23 24
M  V30 26 1 23 25
M  V30 27 1 22 26
M  V30 28 2 26 27
M  V30 29 1 16 27
M  V30 30 1 27 28
M  V30 31 1 28 29
M  V30 32 1 28 30
M  V30 33 1 3 31
M  V30 34 1 31 32
M  V30 35 1 32 33
M  V30 36 1 33 34
M  V30 37 1 34 35
M  V30 38 1 35 36
M  V30 39 1 31 36
M  V30 40 9 37 2
M  V30 41 1 37 38
M  V30 42 2 38 39
M  V30 43 1 39 40
M  V30 44 2 40 41
M  V30 45 2 37 42
M  V30 46 1 41 42
M  V30 47 1 42 43
M  V30 48 2 43 44
M  V30 49 1 44 45
M  V30 50 2 45 46
M  V30 51 1 46 47
M  V30 52 2 47 48
M  V30 53 1 43 48
M  V30 54 1 48 49
M  V30 55 9 49 2
M  V30 END BOND
M  V30 END CTAB
M  END