
     RDKit          3D

129131  0  0  0  0  0  0  0  0999 V2000
   -5.3114    7.0668   -2.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2419    7.5557   -1.8989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9193    8.1708   -1.7004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9567    7.2128   -0.9999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8408    5.9693   -1.7221 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7929    5.1283   -1.5497 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6763    4.3081   -0.5134 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4159    3.3124   -0.4898 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2650    3.1308    0.5616 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5943    2.4638    0.5107 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8534    3.1982    0.9455 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5920    1.1692    0.2009 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7332    0.1421    0.0634 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0121   -0.0665   -1.4573 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9873   -1.0863   -1.6731 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3051   -0.6778   -1.4035 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.9948   -0.6545   -2.6314 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6559   -1.8848   -2.9841 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.5063   -2.0453   -4.4857 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2686   -3.2281   -2.2626 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.4260   -4.0252   -2.1730 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6501   -3.0539   -0.8654 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.0654   -4.0086    0.1026 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9567   -4.8369    0.4434 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9462   -1.6458   -0.3655 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.3651   -1.4566   -0.3891 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8905   -1.1028    0.8483 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2352   -1.2300    0.6975 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3867   -1.2936    2.2008 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8261   -1.3394    2.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8699   -1.5845    0.3954 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5777   -2.9836    0.2806 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -3.5340   -0.4102 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4032   -2.0252    1.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6478   -1.2316    0.1103 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.6143   -2.1405   -0.3374 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3759   -0.0551    0.7748 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.6217   -0.2449    2.2996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7069    0.3784   -0.0095 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.8456    0.2295    0.8351 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8591   -0.6303    0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
   -6.0889    0.0581    0.4536 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1115   -0.5360   -0.2833 C   0  0  2  0  0  0  0  0  0  0  0  0
   -8.4044    0.2063    0.0908 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3396   -2.0273    0.0450 C   0  0  1  0  0  0  0  0  0  0  0  0
   -8.0239   -2.6257   -1.0294 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0391   -2.8225    0.3974 C   0  0  2  0  0  0  0  0  0  0  0  0
   -6.3227   -4.0552    1.1759 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1473   -3.8378    2.3797 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9339   -5.0868    0.3217 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0010   -1.9451    1.1539 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7725   -2.6173    1.2774 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6129    1.8763   -0.4391 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.8069    2.3791   -1.2671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9804    1.6255   -2.5631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8445    0.7463   -2.6642 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4519    2.7882    0.7953 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8754    4.2171    0.4830 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4462    4.8213    1.8130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2743    6.6041   -2.2153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0418    9.0679   -1.0727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5138    8.4882   -2.6848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9518    7.7105   -0.8970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3536    6.9761    0.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6295    2.7773   -1.4081 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2042    3.8629    1.3150 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5655    4.1656    1.4036 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4495    2.6619    1.7193 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4339    3.4521    0.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5992    0.8874   -0.1972 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7124    0.4885    0.6024 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3591    0.8959   -1.9036 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0404   -0.4512   -1.9409 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4162    0.3315   -0.9231 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7480   -1.6878   -2.8058 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4629   -1.7730   -4.7423 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2430   -1.3863   -5.0045 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7136   -3.1000   -4.7947 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5077   -3.7759   -2.8681 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1395   -4.9622   -2.0207 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5635   -3.1711   -1.0846 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2914   -5.6014    1.1735 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4769   -5.3492   -0.4442 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1975   -4.2059    0.9274 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4832   -1.5390    0.6458 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6724   -1.9493    1.5537 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4320   -0.1335    1.1757 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0229   -0.9809    0.7236 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8325   -2.0845    0.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8981   -0.3849    2.6475 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8624   -2.2113    2.5624 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8677   -1.3692    3.7968 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4238   -0.4606    2.3941 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3525   -2.2667    2.3000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2593   -2.7670    1.4839 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5441   -1.5226    2.0288 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1314   -0.7582   -0.7236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2738   -2.4891   -1.1979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5867    0.7410    0.6676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4854    0.3156    2.7312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8312   -1.3163    2.4613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7742    0.1596    2.8750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7558   -0.2482   -0.9934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6853   -0.9077   -0.7358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8708   -0.4018   -1.3464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3844    0.5025    1.1881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4909    1.0953   -0.5538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2903   -0.4570   -0.0809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0090   -2.0153    0.9530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3725   -2.6882   -1.7741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5094   -3.0929   -0.5490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9185   -4.6221    3.1406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2502   -3.8642    2.1633 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9692   -2.8558    2.8641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9814   -4.8124    0.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3445   -5.2367   -0.6248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9783   -6.0460    0.8788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3086   -1.6462    2.1885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9477   -3.4911    1.7297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7123    1.9141   -1.1061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7324    2.2960   -0.6597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6259    3.4618   -1.5235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3294    1.8408   -3.3829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8226    2.2983    1.5711 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4658    2.8675    1.3095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7888    4.7582    0.1000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7517    4.1346    2.3751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3788    5.0196    2.4305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9127    5.7728    1.5785 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 22 25  1  0
 25 26  1  0
 26 27  1  0
 13 28  1  0
 28 29  1  0
 29 30  1  0
 28 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  0
 35 36  1  0
 35 37  1  0
 37 38  1  0
 37 39  1  0
 39 40  1  0
 40 41  1  0
 41 42  1  0
 42 43  1  0
 43 44  1  0
 43 45  1  0
 45 46  1  0
 45 47  1  0
 47 48  1  0
 48 49  1  0
 48 50  1  0
 47 51  1  0
 51 52  1  0
 39 53  1  0
 53 54  1  0
 54 55  1  0
 55 56  2  0
 53 57  1  0
 57 58  1  0
 58 59  1  0
 58  7  1  0
 25 16  1  0
 51 41  1  0
  1 60  1  0
  3 61  1  0
  3 62  1  0
  4 63  1  0
  4 64  1  0
  8 65  1  0
  9 66  1  0
 11 67  1  0
 11 68  1  0
 11 69  1  0
 12 70  1  0
 13 71  1  1
 14 72  1  0
 14 73  1  0
 16 74  1  1
 18 75  1  6
 19 76  1  0
 19 77  1  0
 19 78  1  0
 20 79  1  6
 21 80  1  0
 22 81  1  6
 24 82  1  0
 24 83  1  0
 24 84  1  0
 25 85  1  1
 27 86  1  0
 27 87  1  0
 27 88  1  0
 28 89  1  6
 29 90  1  0
 29 91  1  0
 30 92  1  0
 30 93  1  0
 30 94  1  0
 34 95  1  0
 34 96  1  0
 35 97  1  6
 36 98  1  0
 37 99  1  1
 38100  1  0
 38101  1  0
 38102  1  0
 39103  1  6
 41104  1  6
 43105  1  6
 44106  1  0
 44107  1  0
 44108  1  0
 45109  1  1
 46110  1  0
 47111  1  6
 49112  1  0
 49113  1  0
 49114  1  0
 50115  1  0
 50116  1  0
 50117  1  0
 51118  1  1
 52119  1  0
 53120  1  6
 54121  1  0
 54122  1  0
 55123  1  0
 57124  1  0
 57125  1  0
 58126  1  6
 59127  1  0
 59128  1  0
 59129  1  0
M  END
$$$$
