
     RDKit          3D

124126  0  0  0  0  0  0  0  0999 V2000
   -7.2602    1.0336   -3.4198 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8344    2.3035   -2.6790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3120    2.0040   -1.2404 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.9944    1.2853   -1.2461 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1472    1.1884   -2.2904 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1311    0.4454   -1.8749 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3982    0.1221   -0.5933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5275    0.6534   -0.2014 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4964   -0.6940    0.2886 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.0286   -1.9844   -0.4204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0002   -2.8001    0.3848 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3815   -2.1204    0.4978 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6268   -1.5279    1.8920 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9820   -0.9881    1.9837 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3589    0.2626    1.3908 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4899    0.9810    0.8240 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7847    0.7319    1.5106 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0978    1.9406    0.6145 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5472    2.3352    0.6989 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1219    2.3718    1.8220 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2498    2.7421   -0.4850 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6571    3.1413   -0.4771 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5433    1.9861   -0.9316 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4747    0.9363    0.0129 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3147   -0.1367   -0.3758 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6399   -0.0789    0.3806 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4492   -1.1607   -0.0344 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7295   -1.0907    0.5642 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7172   -0.3803   -0.3727 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1456   -0.3297    0.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8947   -1.6628    0.0172 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3119   -1.6354    0.6163 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2973   -0.7285   -0.1325 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5702   -1.2845   -1.8057 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1497   -0.9791    1.5778 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1993   -1.9450    1.7617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9291   -3.0484    2.3101 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6279   -1.6342    1.4016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9448   -2.0935    0.0470 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1867   -1.8255   -0.6289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2443   -2.0255   -1.8739 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4222   -1.3349    0.1011 C   0  0  2  0  0  0  0  0  0  0  0  0
   -9.0858   -2.4229    0.9836 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7847   -3.5930    0.2388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7819   -4.6455   -0.2600 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7985   -4.2676    1.1749 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3964   -0.7573   -0.8333 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3456    0.2229   -0.4046 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4913   -0.1445   -0.0260 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0089    1.6821   -0.4537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5169    2.1423    0.8412 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1275    2.3811    1.0954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5420    1.6813    1.9648 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3679    3.5414    0.4818 C   0  0  2  0  0  0  0  0  0  0  0  0
   -8.1569    4.5754   -0.3092 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0900    5.2845   -1.1387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8116    4.4495   -0.9778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1867    3.1830   -0.3274 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6323    1.3014   -4.4314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4030    0.3377   -3.5356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0758    0.5171   -2.8772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0587    2.8029   -3.2955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7147    2.9713   -2.6382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0105    1.2643   -0.8013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6051   -0.0588    0.4760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5833   -1.7314   -1.4084 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9050   -2.6330   -0.6247 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4057   -3.0593    1.3847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8628   -3.7671   -0.1472 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5016   -1.3336   -0.2782 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1701   -2.8836    0.3096 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5090   -2.3307    2.6533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1125   -0.7320    2.1246 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6860   -1.5111    2.5525 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9722    0.9972    2.5742 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4565   -0.1105    1.2388 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8426    1.6871   -0.4382 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4788    2.8101    0.9280 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7664    2.6806   -1.4093 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7903    3.9963   -1.1751 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9713    3.4854    0.5307 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1924    1.6430   -1.9332 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5861    2.3625   -1.0234 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8013   -1.0857   -0.1070 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5063   -0.1854   -1.4755 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1338    0.8943    0.1645 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4272   -0.1508    1.4709 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0711   -2.1324    0.7264 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7222   -0.6013    1.5672 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7183   -0.8777   -1.3665 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3730    0.6645   -0.5262 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.6918    0.4645   -0.3564 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1202   -0.0421    1.2676 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3328   -2.4678    0.5333 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.9392   -1.9315   -1.0606 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.2553   -1.3067    1.6765 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.7176   -2.6714    0.6151 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.9494    0.3239   -0.1408 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.2748   -0.7508    0.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7005   -0.5935    2.4412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8040   -0.5436    1.4905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2918   -2.1350    2.1316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2075   -2.5874   -0.5056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0880   -0.5293    0.7833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8435   -1.8964    1.6057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3538   -2.8377    1.7035 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3572   -3.2079   -0.6303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1121   -4.9743    0.5618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1702   -4.2487   -1.0925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3178   -5.5338   -0.6561 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5781   -3.5403    1.4852 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3077   -5.1096    0.6570 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2909   -4.6601    2.0830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6495   -1.2983   -1.6896 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9192    2.2604   -0.7206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2617    1.8561   -1.2467 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1366    1.9869    1.6700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9796    4.0952    1.3692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9046    4.1132   -0.9816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6783    5.2857    0.3699 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9244    6.3167   -0.7625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3902    5.3383   -2.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2668    4.3163   -1.9339 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1131    4.9897   -0.3009 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
  9 35  1  0
 35 36  1  0
 36 37  2  0
 36 38  1  0
 38 39  1  0
 39 40  1  0
 40 41  2  0
 40 42  1  0
 42 43  1  0
 43 44  1  0
 44 45  1  0
 44 46  1  0
 42 47  1  0
 47 48  1  0
 48 49  2  0
 48 50  1  0
 50 51  1  0
 51 52  1  0
 52 53  2  0
 52 54  1  0
 54 55  1  0
 55 56  1  0
 56 57  1  0
 57 58  1  0
 58  3  1  0
  8  4  1  0
 58 54  1  0
  1 59  1  0
  1 60  1  0
  1 61  1  0
  2 62  1  0
  2 63  1  0
  3 64  1  1
  9 65  1  1
 10 66  1  0
 10 67  1  0
 11 68  1  0
 11 69  1  0
 12 70  1  0
 12 71  1  0
 13 72  1  0
 13 73  1  0
 14 74  1  0
 17 75  1  0
 17 76  1  0
 18 77  1  0
 18 78  1  0
 21 79  1  0
 22 80  1  0
 22 81  1  0
 23 82  1  0
 23 83  1  0
 25 84  1  0
 25 85  1  0
 26 86  1  0
 26 87  1  0
 28 88  1  0
 28 89  1  0
 29 90  1  0
 29 91  1  0
 30 92  1  0
 30 93  1  0
 31 94  1  0
 31 95  1  0
 32 96  1  0
 32 97  1  0
 33 98  1  0
 33 99  1  0
 35100  1  0
 38101  1  0
 38102  1  0
 39103  1  0
 42104  1  1
 43105  1  0
 43106  1  0
 44107  1  0
 45108  1  0
 45109  1  0
 45110  1  0
 46111  1  0
 46112  1  0
 46113  1  0
 47114  1  0
 50115  1  0
 50116  1  0
 51117  1  0
 54118  1  1
 55119  1  0
 55120  1  0
 56121  1  0
 56122  1  0
 57123  1  0
 57124  1  0
M  END
$$$$
