B4158.sdf
  ChemDraw08061414102D

102109  0  0  0  0  0  0  0  0999 V2000
    2.4645    4.0908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3129   -4.0908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0806    4.4465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -2.3122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -3.0236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8484    3.0236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5452    2.3122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5452    0.8893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7774    4.4465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7774   -1.2450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7774    0.1779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7774    3.0236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4645   -2.3122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6161    2.3122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4645    7.6480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3129   -7.6480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2323    8.3595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0806   -8.3595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6161    0.8893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4645   -0.8893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9290   -2.3122    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6968    3.3794    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2323   -0.8893    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6161    0.8893    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0806    3.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9290   -3.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5452   -3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0806    2.3122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1613   -3.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6968    1.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5452   -1.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3129    3.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1613   -2.3122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3129    2.3122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6968    4.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3129   -1.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3129   -1.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3129    4.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4645    3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3129   -3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -0.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3129    5.1580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9290   -0.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9290    4.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -4.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8484    4.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9290    5.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -5.1580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8484    5.1580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5452    4.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5452   -1.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9290    3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9290   -0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2323    4.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0806   -4.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0806   -5.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2323    5.5137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5452    0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5452    3.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1613   -0.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1613    4.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1613   -0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1613    3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2323    3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0806   -3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6161    4.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4645   -4.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0806   -6.2251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2323    6.2251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6161    3.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4645   -3.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8484   -4.0908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8484   -3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8484    6.5809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -6.5809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4645   -6.5809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6161    6.5809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9290    1.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9290    1.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7774   -1.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7774    5.1580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8484    7.2923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -7.2923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6161    7.2923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4645   -7.2923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3935   -0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3935    3.3794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0806   -7.6480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2323    7.6480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8484   -1.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.9565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8484   -1.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3129   -8.3595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4645    8.3595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2323   -0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6161    0.1779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6968   -8.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8484    8.7152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 39  1  0      
 46  1  1  1      
  2 40  1  0      
 45  2  1  6      
  3 35  2  0      
  4 36  2  0      
  5 40  2  0      
  6 39  2  0      
  7 60  1  0      
  7 82  1  0      
  8 59  1  0      
  8 81  1  0      
  9 62  1  0      
  9 84  1  0      
 10 61  1  0      
 10 83  1  0      
 11 63  1  0      
 11 89  1  0      
 12 64  1  0      
 12 90  1  0      
 13 72  1  0      
 13 93  1  0      
 14 71  1  0      
 14 94  1  0      
 15 85  1  0      
 15 98  1  0      
 16 86  1  0      
 16 97  1  0      
 17 92  1  0      
 17102  1  0      
 18 91  1  0      
 18101  1  0      
 19 96  2  0      
 20 95  2  0      
 21 26  1  0      
 21 31  1  0      
 21 36  1  0      
 22 25  1  0      
 22 32  1  0      
 22 35  1  0      
 23 95  1  0      
 23 99  1  0      
 24 96  1  0      
 24100  1  0      
 25 28  1  0      
 25 39  1  1      
 26 27  1  0      
 26 40  1  6      
 27 29  1  0      
 28 30  1  0      
 29 33  1  0      
 30 34  1  0      
 31 33  1  0      
 32 34  1  0      
 35 38  1  0      
 36 37  1  0      
 37 41  1  1      
 37 43  1  0      
 38 42  1  6      
 38 44  1  0      
 41 47  1  0      
 42 48  1  0      
 43 52  1  0      
 43 54  2  0      
 44 51  1  0      
 44 53  2  0      
 45 49  1  0      
 45 56  1  0      
 46 50  1  0      
 46 55  1  0      
 49 57  1  0      
 50 58  1  0      
 51 62  2  0      
 52 61  2  0      
 60 53  1  0      
 59 54  1  0      
 55 65  1  0      
 55 67  2  0      
 56 66  1  0      
 56 68  2  0      
 57 69  1  0      
 58 70  1  0      
 63 59  2  0      
 64 60  2  0      
 61 63  1  0      
 62 64  1  0      
 65 71  2  0      
 66 72  2  0      
 73 67  1  0      
 74 68  1  0      
 69 78  1  0      
 69 79  2  0      
 70 77  2  0      
 70 80  1  0      
 71 75  1  0      
 72 76  1  0      
 75 73  2  0      
 76 74  2  0      
 77 85  1  0      
 78 86  2  0      
 88 79  1  0      
 80 87  2  0      
 85 92  2  0      
 86 91  1  0      
 87 92  1  0      
 91 88  2  0      
 93 95  1  0      
 94 96  1  0      
 99100  1  0      
V    1 0
V    2 1
V    3 2
V    4 3
V    5 4
V    6 5
V    7 6
V    8 7
V    9 8
V   10 9
V   11 10
V   12 11
V   13 12
V   14 13
V   15 14
V   16 15
V   17 16
V   18 17
V   19 18
V   20 19
V   21 20
V   22 21
V   23 22
V   24 23
V   25 24
V   26 25
V   27 26
V   28 27
V   29 28
V   30 29
V   31 30
V   32 31
V   33 32
V   34 33
V   35 34
V   36 35
V   37 36
V   38 37
V   39 38
V   40 39
V   41 40
V   42 41
V   43 42
V   44 43
V   45 44
V   46 45
V   47 46
V   48 47
V   49 48
V   50 49
V   51 50
V   52 51
V   53 52
V   54 53
V   55 54
V   56 55
V   57 56
V   58 57
V   59 58
V   60 59
V   61 60
V   62 61
V   63 62
V   64 63
V   65 64
V   66 65
V   67 66
V   68 67
V   69 68
V   70 69
V   71 70
V   72 71
V   73 72
V   74 73
V   75 74
V   76 75
V   77 76
V   78 77
V   79 78
V   80 79
V   81 80
V   82 81
V   83 82
V   84 83
V   85 84
V   86 85
V   87 86
V   88 87
V   89 88
V   90 89
V   91 90
V   92 91
V   93 92
V   94 93
V   95 94
V   96 95
V   97 96
V   98 97
V   99 98
V  100 99
V  101 100
V  102 101
M  END
$$$$
