
     RDKit          3D

142148  0  0  0  0  0  0  0  0999 V2000
   -9.2420    0.9136    0.9258 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2154    2.4052    1.3045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8113    3.3830    0.1505 C   0  0  2  0  0  0  0  0  0  0  0  0
   -9.6930    3.2140   -1.0987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2843    3.2654   -0.1916 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.9414    1.8788   -0.2661 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5392    1.6804   -0.4700 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.1734    2.2991   -1.8010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4992    3.5877   -1.9022 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8622    4.0246   -1.5011 C   0  0  2  0  0  0  0  0  0  0  0  0
   -6.9743    5.5411   -1.3274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3488    0.1257   -0.4658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6695   -0.3209    0.8394 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.3641    0.4403    0.9669 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4427    1.9419    0.7388 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4411    2.5665   -0.3071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3322    1.6457   -0.9390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0649    1.4195   -2.2870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4824    2.4161   -3.3667 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0729    0.4646   -2.7451 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.2465    0.7494   -1.9682 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4599    0.6869   -2.7667 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3722    1.9722   -2.5518 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2523    1.8868   -1.2631 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.2734    2.8630   -1.3765 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3587    3.6272   -0.2006 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8567    0.4865   -1.1479 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.6223    0.3964    0.0314 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8284   -0.3159   -0.1802 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.8949    0.6286   -0.7586 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5459    1.4701    0.3041 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.7107    2.0612   -0.2473 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5252    3.4578   -0.4192 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9570    0.6282    1.4592 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7141    1.1902    2.4278 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3797    0.4448    3.5625 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8319    0.6054    3.4799 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3499   -0.1546    2.3428 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4956   -0.8325    1.4718 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.4474   -1.8026    0.7538 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1551   -0.9924    1.0259 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6643   -0.4641   -1.1089 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0060   -1.9107   -0.6652 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1709   -0.4979   -2.4427 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2937   -1.0686   -2.7920 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8727   -1.9699   -3.1981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9951   -1.5793   -1.5446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6951   -2.6986   -0.7932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5208   -2.9405    0.4049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1502   -4.0961    0.7221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0154   -5.4301    0.0778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6527   -6.3722    0.9574 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0131   -5.6619    2.1228 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.2604   -6.2901    2.8368 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.5909   -7.5255    2.2199 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5013   -5.3842    2.8284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5162   -5.4945    3.9716 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7075   -4.4489    1.8885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6210   -4.1524    0.8879 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.9199   -2.8118    0.3182 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7259   -2.7712   -0.6675 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2223   -1.6961    0.7957 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2657   -4.2200    1.6744 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.1826   -3.2809    2.7029 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7898    2.3605    0.5909 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2721    0.7530   -0.1750 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0857    0.4225    1.4220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3039    0.4215    1.2797 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1723    2.6984    1.7107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4759    2.5443    2.1393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9778    4.3994    0.5305 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7484    2.9196   -0.8545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3234    2.3776   -1.7371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6478    4.1507   -1.6848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7834    3.6915    0.7306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2703    1.9019   -2.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8066    4.2698   -2.3682 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4963    3.6530   -2.3334 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3632    5.8639   -0.4784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5973    6.0188   -2.2589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0290    5.8606   -1.1843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8032   -0.1915   -1.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3612   -0.3613   -0.4712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2591   -0.1000    1.7575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7439    0.2046    1.8426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7629    0.0102    0.1830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1138    2.3801    1.6865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9759    3.1427   -1.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9104    3.4062    0.1433 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4705    1.6491   -0.3064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3518    3.0681   -3.1258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5789    3.0668   -3.5366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6873    1.9194   -4.3662 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2330    0.6492   -3.8093 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3015    0.6904   -3.8572 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0507    2.0531   -3.4116 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7218    2.8712   -2.4901 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5813    2.0379   -0.4033 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3005    3.0005    0.7220 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5330    4.3731   -0.1809 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3236    4.1163   -0.1697 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4343    0.3004   -2.0810 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7117   -1.1385   -0.9519 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4880    1.2658   -1.5539 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6812   -0.0014   -1.2703 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7856    2.1931    0.6805 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4289    3.9638    0.5830 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3958    3.8628   -0.9464 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6303    3.6513   -1.0321 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9263    2.2288    2.3566 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0266    0.9080    4.5077 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1214   -0.6337    3.6244 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0541    1.6223    3.3356 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1683   -1.2378    2.4509 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4340    0.0092    2.2754 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8995    0.1969    1.3873 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4176   -1.1917    2.5541 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0624   -1.2792    0.0139 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8603   -2.5868    0.2573 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1233   -2.2875    1.4670 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8957   -0.1184   -0.3655 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0475   -2.4616   -0.5800 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4489   -1.8968    0.3406 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6717   -2.4003   -1.3794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0443   -1.1737   -3.5969 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5457   -2.1511   -2.3496 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4127   -1.5372   -4.0728 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4683   -2.9551   -3.5085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6266   -0.8508   -1.1980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1288   -3.5262   -1.1869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7884   -2.0441    0.9429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5749   -5.4080   -0.8964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9623   -5.6824    0.0502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1693   -5.6938    2.8314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9952   -6.4581    3.8904 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4505   -7.8383    2.6279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2985   -6.3962    4.5815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4731   -4.5914    4.5965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5150   -5.5970    3.5088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6231   -3.8619    1.8872 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7017   -4.9365    0.1079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5050   -3.7435    3.5414 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
  3  5  1  0
  5  6  1  0
  7  6  1  1
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
  7 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 24 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
 31 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 34 39  1  0
 39 40  1  0
 39 41  1  0
 27 42  1  0
 42 43  1  0
 42 44  1  0
 20 45  1  0
 45 46  1  0
 45 47  1  0
 47 48  2  0
 48 49  1  0
 49 50  2  0
 50 51  1  0
 51 52  1  0
 52 53  1  0
 53 54  1  0
 54 55  1  0
 54 56  1  0
 56 57  1  0
 56 58  2  0
 58 59  1  0
 59 60  1  0
 60 61  2  0
 60 62  1  0
 59 63  1  0
 63 64  1  1
 15 65  1  0
 10  5  1  0
 62 13  1  0
 65  7  1  0
 44 22  1  0
 63 50  1  0
 41 29  1  0
 63 53  1  0
  1 66  1  0
  1 67  1  0
  1 68  1  0
  2 69  1  0
  2 70  1  0
  3 71  1  1
  4 72  1  0
  4 73  1  0
  4 74  1  0
  5 75  1  1
  8 76  1  0
  9 77  1  0
 10 78  1  6
 11 79  1  0
 11 80  1  0
 11 81  1  0
 12 82  1  0
 12 83  1  0
 13 84  1  1
 14 85  1  0
 14 86  1  0
 15 87  1  1
 16 88  1  0
 16 89  1  0
 17 90  1  0
 19 91  1  0
 19 92  1  0
 19 93  1  0
 20 94  1  6
 22 95  1  6
 23 96  1  0
 23 97  1  0
 24 98  1  1
 26 99  1  0
 26100  1  0
 26101  1  0
 27102  1  6
 29103  1  6
 30104  1  0
 30105  1  0
 31106  1  1
 33107  1  0
 33108  1  0
 33109  1  0
 35110  1  0
 36111  1  0
 36112  1  0
 37113  1  0
 38114  1  0
 38115  1  0
 38116  1  0
 39117  1  1
 40118  1  0
 40119  1  0
 40120  1  0
 42121  1  1
 43122  1  0
 43123  1  0
 43124  1  0
 45125  1  6
 46126  1  0
 46127  1  0
 46128  1  0
 47129  1  0
 48130  1  0
 49131  1  0
 51132  1  0
 51133  1  0
 53134  1  1
 54135  1  1
 55136  1  0
 57137  1  0
 57138  1  0
 57139  1  0
 58140  1  0
 59141  1  6
 64142  1  0
M  END
$$$$
