
     RDKit          3D

126129  0  0  0  0  0  0  0  0999 V2000
   -1.9853    4.0171    3.2465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0152    4.5754    2.5151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2914    5.3184    1.2319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4146    4.4082   -0.0181 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.5638    3.4083    0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8820    3.6680    0.2033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4191    5.0737    0.3164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8657    2.5043    0.1842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7911    1.5861    1.4372 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.4297    0.8947    1.6415 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9588    0.5600    1.5246 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3994   -0.2168    0.2484 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.3727   -1.1746    0.6421 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6831   -0.6710    0.4890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2552   -0.9607   -0.5006 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.5060   -1.7390    0.4242 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3932   -2.4225   -0.1597 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4017   -1.5150   -0.5965 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8045   -3.2672    0.9595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5201   -4.1760    1.4577 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4661   -3.0369    1.5653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2367   -3.5033    2.7173 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3776   -2.4477    0.8304 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3673   -3.3369   -0.0795 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8905   -3.1165    0.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3499   -2.8537    1.4507 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5255   -1.7669    2.1947 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3040   -1.2691    1.4004 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7068   -0.2887    0.3108 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0933   -0.2917   -0.7897 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7423    0.6350    0.5181 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7889    0.8495   -0.4305 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.1005    0.3202    0.1551 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3930    0.5070    1.6340 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9983   -0.2863   -0.6590 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3437   -0.8214   -0.1973 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.4233    0.2605   -0.3179 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7511   -0.1989    0.3112 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9623   -1.7330    0.2841 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4914   -2.3047    1.4849 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2711   -2.4006   -0.9279 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.9177   -1.9448   -2.1074 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1311   -3.0096   -3.0052 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7533   -2.0767   -1.0047 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9203    2.3507   -0.8730 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.2977    3.3028    0.2787 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7752    2.8947   -1.8215 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9658    1.8613   -2.3128 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8649    4.0396   -1.2943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1139    3.6482   -0.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1578    2.7403    0.5575 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8574   -3.3598   -1.3236 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.6843   -4.0603   -2.0274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7030   -2.5898   -2.3470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8346   -1.8357   -1.6428 C   0  0  2  0  0  0  0  0  0  0  0  0
   -6.4910   -0.9931   -2.5771 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5917   -1.6546   -3.1628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7377    3.5127    4.1755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0261    4.0682    2.9337 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0104    4.5249    2.8803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4399    6.0087    1.0593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1701    5.9793    1.3586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5783    5.0710   -0.8961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2999    2.3857   -0.2127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4870    5.1155    0.0139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3573    5.4148    1.3683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8701    5.7648   -0.3553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7050    1.9439   -0.7541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9000    2.9060    0.1294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9166    2.2552    2.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4905    0.0919    2.4026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0626    0.4606    0.6983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6760    1.6162    2.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7478   -0.1759    2.3354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8478    1.1253    1.8780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8092    0.5291   -0.4725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4011   -1.4700    0.7605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8890   -0.3798   -0.5619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8636    0.1914    1.1697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6175   -0.1888   -0.9572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7145   -1.0077   -1.3776 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1657   -4.4021    0.1744 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0260   -3.1643   -1.1239 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4125   -4.0150   -0.3907 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1902   -2.2649   -0.6410 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4228   -2.5599    1.4346 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2868   -3.8127    2.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1600   -2.2097    3.1512 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1724   -0.9194    2.4916 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3809   -0.7283    2.0884 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5735    0.2431   -1.3365 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3345    1.0708    1.7741 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4830   -0.4782    2.1372 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5837    1.0736    2.1413 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7751   -0.3535   -1.7199 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2702   -1.1364    0.8629 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5878    0.4922   -1.3915 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0951    1.1989    0.1730 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8048    0.1582    1.3627 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5862    0.2942   -0.2344 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0640   -1.9198    0.2084 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9444   -3.1815    1.5808 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3784   -3.5046   -0.7841 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1840   -3.5545   -3.2217 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9007   -3.7102   -2.6086 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5075   -2.5905   -3.9653 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1690   -2.9392   -0.6287 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4749   -1.9481   -2.0748 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8292    2.3535   -1.5258 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5263    3.3088    1.0753 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2679    3.0141    0.7230 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4489    4.3326   -0.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2988    3.3680   -2.6911 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4528    1.4418   -3.0708 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2797    4.4157   -2.1638 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4643    4.9020   -0.9465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5109   -4.1566   -0.9000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0077   -3.3151   -2.5035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0670   -4.7425   -2.8169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1050   -4.6677   -1.3030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1333   -3.3108   -3.0719 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0771   -1.8777   -2.9215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5165   -2.5965   -1.1869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3602   -1.9080   -2.4006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2777   -2.5699   -3.7053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0655   -0.9733   -3.8967 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 12 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  6
 17 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  2  0
 21 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  2  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 33 35  2  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 39 41  1  0
 41 42  1  0
 42 43  1  0
 41 44  1  0
 32 45  1  0
 45 46  1  0
 45 47  1  0
 47 48  1  0
 47 49  1  0
 49 50  1  0
 50 51  2  0
 17 52  1  0
 52 53  1  0
 52 54  1  0
 54 55  1  0
 55 56  1  0
 56 57  1  0
 50  4  1  0
 55 15  1  0
 28 23  1  0
 44 36  1  0
  1 58  1  0
  1 59  1  0
  2 60  1  0
  3 61  1  0
  3 62  1  0
  4 63  1  6
  5 64  1  0
  7 65  1  0
  7 66  1  0
  7 67  1  0
  8 68  1  0
  8 69  1  0
  9 70  1  1
 10 71  1  0
 10 72  1  0
 10 73  1  0
 11 74  1  0
 11 75  1  0
 12 76  1  6
 14 77  1  0
 14 78  1  0
 14 79  1  0
 15 80  1  6
 18 81  1  0
 24 82  1  0
 24 83  1  0
 25 84  1  0
 25 85  1  0
 26 86  1  0
 26 87  1  0
 27 88  1  0
 27 89  1  0
 28 90  1  1
 32 91  1  6
 34 92  1  0
 34 93  1  0
 34 94  1  0
 35 95  1  0
 36 96  1  1
 37 97  1  0
 37 98  1  0
 38 99  1  0
 38100  1  0
 39101  1  6
 40102  1  0
 41103  1  1
 43104  1  0
 43105  1  0
 43106  1  0
 44107  1  0
 44108  1  0
 45109  1  6
 46110  1  0
 46111  1  0
 46112  1  0
 47113  1  6
 48114  1  0
 49115  1  0
 49116  1  0
 52117  1  1
 53118  1  0
 53119  1  0
 53120  1  0
 54121  1  0
 54122  1  0
 55123  1  1
 57124  1  0
 57125  1  0
 57126  1  0
M  END
$$$$
