
     RDKit          3D

138138  0  0  0  0  0  0  0  0999 V2000
    9.0418   -1.7236    1.0833 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3773   -0.5177    1.7475 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8676   -0.7139    1.9544 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0718   -0.6172    0.6440 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5716   -0.8237    0.9104 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6653   -0.5783   -0.3136 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0060   -1.4929   -1.4099 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0438   -2.2794   -2.1329 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2820   -2.5450   -3.3449 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7762   -2.8143   -1.4776 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9985   -3.7415   -2.4263 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0893   -3.5263   -0.2231 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1528   -4.5392   -0.1822 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4654   -3.1658    1.0268 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2001   -2.8788    2.0110 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0266   -3.2636    1.2665 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.4595   -4.7050    1.5978 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5129   -5.6311    0.3746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8393   -7.0730    0.7855 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9641   -8.0142   -0.4235 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3687   -8.2421   -1.1390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7870   -2.7534    0.1688 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5842   -1.5988    0.2378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5544   -0.8551    1.2574 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5194   -1.2480   -0.8897 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.0719   -1.8433   -2.2272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9036   -1.6643   -0.5849 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2064   -3.0584   -0.2354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0116   -0.7857   -0.8711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0078   -1.2354   -1.5006 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9730    0.6749   -0.4751 C   0  0  2  0  0  0  0  0  0  0  0  0
   -6.3604    1.2368   -0.0758 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6877    1.0743    1.4216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8916   -0.3770    1.8864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1752   -1.0047    1.3251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4070   -2.3948    1.9096 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4258    1.4586   -1.5835 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3258    2.3728   -1.4496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4976    2.4448   -2.3965 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1574    3.2596   -0.2231 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2911    2.6114    0.8676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6384    4.6006   -0.5905 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4450    5.7961   -0.3231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4125    4.7955   -1.3285 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4572    5.4108   -2.4297 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0900    4.2597   -0.8280 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0916    5.1714   -1.2221 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0463    6.5259   -0.4990 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2950    7.3568   -0.8167 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2302    8.7292   -0.1374 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4897    9.5441   -0.4183 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1037    2.9554   -1.3766 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9405    1.9478   -0.8688 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9316    0.8332   -1.4557 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8096    2.1193    0.3681 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.3471    1.2028    1.5085 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2451    1.9313    0.0611 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1958    2.9932    0.4037 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7335    0.8616   -0.7712 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3132    1.1474   -1.8548 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6979   -1.8368    0.0346 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8135   -2.6529    1.6484 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1417   -1.5793    1.0724 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5659    0.3954    1.1422 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8505   -0.3655    2.7424 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5092    0.0779    2.6476 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6813   -1.6965    2.4419 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4243   -1.3980   -0.0587 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2485    0.3800    0.1857 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2446   -0.1505    1.7331 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4231   -1.8659    1.2604 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6343   -0.7785    0.0088 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9545   -1.4074   -1.8407 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1253   -1.9409   -1.2668 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0584   -4.0779   -1.9518 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5996   -4.6366   -2.6903 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7275   -3.2014   -3.3590 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7821   -5.4631    0.3087 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4996   -4.8059   -1.2026 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0190   -4.1514    0.3914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2428   -2.6682    2.1815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4737   -4.6694    2.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2324   -5.1283    2.3597 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4653   -5.6177   -0.1373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2931   -5.2695   -0.3297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8065   -7.0817    1.3337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0559   -7.4570    1.4755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7078   -7.6117   -1.1446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3410   -8.9968   -0.0650 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6836   -7.3267   -1.6812 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2550   -9.0588   -1.8835 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1589   -8.5333   -0.4145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4636   -0.1489   -1.0046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0502   -1.4899   -2.4807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0820   -2.9524   -2.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7622   -1.5110   -3.0328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2825   -3.6568   -0.0990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8055   -3.5318   -1.0419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7822   -3.0864    0.7132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3010    0.7454    0.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3681    2.3293   -0.2785 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1720    0.8181   -0.7060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8673    1.5275    2.0195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6057    1.6586    1.6514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9594   -0.3679    2.9965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0108   -0.9963    1.6216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0487   -0.3629    1.5748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1094   -1.0940    0.2214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5524   -3.0617    1.6666 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3330   -2.8305    1.4780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5252   -2.3352    3.0130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7576    1.2414   -2.5509 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1682    3.3752    0.2220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4669    2.0183    0.4299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8803    3.3880    1.5460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8898    1.9389    1.5119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3424    5.5648    0.2882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8344    6.5380    0.2351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7800    6.2469   -1.2815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1510    4.2072    0.2763 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1001    5.3305   -2.3228 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0443    4.6643   -0.9655 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1393    7.0858   -0.8174 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9893    6.3573    0.5996 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1985    6.8121   -0.4619 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3749    7.4958   -1.9180 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3472    9.2911   -0.5144 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1237    8.6015    0.9617 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6322    9.6755   -1.5120 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3816    9.0348    0.0093 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3956   10.5467    0.0506 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6794    3.1430    0.7624 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1373    1.1231    2.2843 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4423    1.6332    1.9888 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0749    0.1895    1.1546 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8385    3.5853    1.2747 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1778    2.5538    0.6831 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3327    3.6690   -0.4667 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  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  2  0
 14 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 16 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 25 27  1  0
 27 28  1  0
 27 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 31 37  1  0
 37 38  1  0
 38 39  2  0
 38 40  1  0
 40 41  1  0
 40 42  1  0
 42 43  1  0
 42 44  1  0
 44 45  2  0
 44 46  1  0
 46 47  1  0
 47 48  1  0
 48 49  1  0
 49 50  1  0
 50 51  1  0
 46 52  1  0
 52 53  1  0
 53 54  2  0
 53 55  1  0
 55 56  1  0
 55 57  1  0
 57 58  1  0
 57 59  1  0
 59 60  2  0
 59  6  1  0
  1 61  1  0
  1 62  1  0
  1 63  1  0
  2 64  1  0
  2 65  1  0
  3 66  1  0
  3 67  1  0
  4 68  1  0
  4 69  1  0
  5 70  1  0
  5 71  1  0
  6 72  1  1
  7 73  1  0
 10 74  1  1
 11 75  1  0
 11 76  1  0
 11 77  1  0
 13 78  1  0
 13 79  1  0
 13 80  1  0
 16 81  1  1
 17 82  1  0
 17 83  1  0
 18 84  1  0
 18 85  1  0
 19 86  1  0
 19 87  1  0
 20 88  1  0
 20 89  1  0
 21 90  1  0
 21 91  1  0
 21 92  1  0
 25 93  1  6
 26 94  1  0
 26 95  1  0
 26 96  1  0
 28 97  1  0
 28 98  1  0
 28 99  1  0
 31100  1  1
 32101  1  0
 32102  1  0
 33103  1  0
 33104  1  0
 34105  1  0
 34106  1  0
 35107  1  0
 35108  1  0
 36109  1  0
 36110  1  0
 36111  1  0
 37112  1  0
 40113  1  1
 41114  1  0
 41115  1  0
 41116  1  0
 43117  1  0
 43118  1  0
 43119  1  0
 46120  1  1
 47121  1  0
 47122  1  0
 48123  1  0
 48124  1  0
 49125  1  0
 49126  1  0
 50127  1  0
 50128  1  0
 51129  1  0
 51130  1  0
 51131  1  0
 55132  1  1
 56133  1  0
 56134  1  0
 56135  1  0
 58136  1  0
 58137  1  0
 58138  1  0
M  END
$$$$
