B5174.sdf
  ChemDraw07151711312D

142142  0  0  0  0  0  0  0  0999 V2000
    0.8218   -1.1422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0646   -2.5504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9335   12.0486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1094   10.8812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5587    3.7783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6188   -7.1936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7839   -4.9349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7855  -10.5658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6450   -7.4691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6307    4.4171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4983    7.5299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5004   -9.7916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8320   -7.3290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3456    3.6429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3581    8.3429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1275   10.8371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5707   -4.7995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2432   -1.8430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8015   10.3614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8558   -5.5737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0562   -1.9832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5985  -10.7059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1729   -6.8351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1028    5.0511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7684    7.1454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2763   -2.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5324   10.7513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0512    0.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1678    5.7519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0181    0.6864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6069    6.1724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5367   -1.9164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8584   11.2270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7846    4.0634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3930   -6.9085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0097   -5.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6873   -9.6515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3041   -7.9630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8734    3.0089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3785   10.4913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0986   -4.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7153   -2.4770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8042   -1.4225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5791    0.2660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2814   11.0971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4902    1.3204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0790    6.8064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5416    8.4608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5505   10.7072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9808    5.8921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3279   -6.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5841   -1.3492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3363    1.6741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0697    4.8376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1078   -6.1343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1967   -5.0798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4022   -8.8773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4911   -7.8228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6865    3.1491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8135   -3.3913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9023   -2.3369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7045   10.9671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5191   -0.6484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3921    0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7753    2.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5735    9.2852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3641    7.5806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3565   11.9187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6966  -11.6203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5138   -6.3413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8600    6.4593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9132   -9.9366    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.2245   10.2314    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2245  -10.9863    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9817  -12.3944    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2286   -5.5671    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3268   -6.4814    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0470    6.3191    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1452    7.2334    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8836  -11.4801    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9859   -6.9753    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3879    5.8253    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8827    4.9777    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2948   -5.9942    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9716    3.9233    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2060   -7.0486    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2660    6.6662    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9116   -4.3057    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5892   -8.7371    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5883    2.2348    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0004   -3.2512    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3034    9.6698    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6172   -1.5627    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2939   -0.5082    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9554   10.6213    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6772    1.1803    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.1771    7.7207    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8311    0.8266    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6255   11.5288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5087    5.2581    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5149   -6.0675    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6130   -6.9818    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2990   -0.5750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3971   -1.4893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1916    2.3081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1493    1.8143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5418    5.4716    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6357   -5.5003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6688   -5.7138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9301   -8.2433    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9632   -8.4568    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2143    2.5151    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3413   -2.7573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3744   -2.9709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7795   11.7887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0470   -0.0144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9200   -0.2279    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2474    2.7286    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8755    9.7251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8362    8.2146    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6825   12.3944    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1055   12.2645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2329    6.4527    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7608    5.8187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6626    4.9044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4199    6.3125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9477    5.6785    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    5.9247    3.2504    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2528   -7.7215    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1499   -4.4070    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5472  -10.4645    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7762   -8.5970    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4013    2.3749    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0524   10.0156    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6265   -3.5315    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1874   -3.1110    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3321   -0.7885    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1069   -0.3680    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2064   10.2755    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9623    1.9544    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5511    7.4404    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8436    8.9007    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
 12  8  1  0      
 13  9  1  0      
 14 10  1  0      
 15 11  1  0      
 19 16  1  0      
 20 17  1  0      
 21 18  1  0      
 22  8  1  0      
 23  9  1  0      
 24 10  1  0      
 25 11  1  0      
 32  1  1  0      
 32  2  1  0      
 32 26  1  0      
 33  3  1  0      
 33  4  1  0      
 33 27  1  0      
 34  5  1  6      
 35  6  1  6      
 36  7  1  1      
 37 12  1  0      
 38 13  1  0      
 39 14  1  0      
 40 16  1  0      
 41 17  1  0      
 42 18  1  0      
 43 26  1  0      
 44 28  1  0      
 45 27  1  0      
 46 30  1  0      
 47 31  1  0      
 48 15  1  0      
 49 19  1  0      
 50 29  1  0      
 51 20  1  0      
 52 21  1  0      
 53 28  1  0      
 54 34  1  0      
 55 35  1  0      
 56 36  1  0      
 57 37  1  0      
 58 38  1  0      
 59 39  1  0      
 60 41  1  0      
 61 42  1  0      
 62 40  1  0      
 63 43  1  0      
 64 44  1  0      
 65 46  1  0      
 48 66  1  6      
 67 47  1  0      
 68 45  1  0      
 37 72  1  1      
 73 49  2  0      
 74 69  2  0      
 75 69  1  0      
 76 70  2  0      
 77 70  1  0      
 78 71  2  0      
 79 71  1  0      
 80 22  1  0      
 80 69  1  0      
 81 23  1  0      
 81 70  1  0      
 82 24  1  0      
 82 71  1  0      
 83 29  1  0      
 83 54  2  0      
 84 36  1  0      
 84 55  2  0      
 85 34  1  0      
 85 59  2  0      
 86 35  1  0      
 86 58  2  0      
 87 47  1  0      
 87 50  2  0      
 88 41  1  0      
 88 56  2  0      
 89 38  1  0      
 89 57  2  0      
 90 39  1  0      
 90 65  2  0      
 91 42  1  0      
 91 60  2  0      
 92 40  1  0      
 92 66  2  0      
 93 43  1  0      
 93 61  2  0      
 94 44  1  0      
 94 63  2  0      
 95 45  1  0      
 95 62  2  0      
 96 46  1  0      
 96 64  2  0      
 97 25  1  0      
 97 48  1  0      
 97 67  1  0      
 98 30  1  0      
 99 49  1  0      
100 50  1  0      
101 51  2  0      
102 51  1  0      
103 52  2  0      
104 52  1  0      
105 53  2  0      
106 53  1  0      
107 54  1  0      
108 55  1  0      
109 56  1  0      
110 57  1  0      
111 58  1  0      
112 59  1  0      
113 60  1  0      
114 61  1  0      
115 62  1  0      
116 63  1  0      
117 64  1  0      
118 65  1  0      
119 66  1  0      
120 67  2  0      
121 68  2  0      
122 68  1  0      
126 31  1  0      
127123  1  0      
127124  1  0      
127125  2  0      
127126  1  0      
 34128  1  1      
 35129  1  1      
 36130  1  6      
 37131  1  6      
 38132  1  6      
 39133  1  6      
 40134  1  1      
 41135  1  1      
 42136  1  6      
 43137  1  1      
 44138  1  6      
 45139  1  6      
 46140  1  1      
 47141  1  1      
 48142  1  1      
M  END
$$$$
