D0X1SN
  -OEChem-10101305022D

108110  0     1  0  0  0  0  0999 V2000
    8.1084    0.2480    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1768    2.4181    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6039   -3.3233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5355   -1.5154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0542   -3.9558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5174   -2.9166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5174    3.7747    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5496   -7.5271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -8.1595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8902    9.7418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1949    1.0168    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0904   -1.1533    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8813   -3.1423    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7949    3.5937    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7587   -5.5381    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5858    5.5827    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8271   -7.3461    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7045   -9.7418    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3859    0.4291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8023   -0.3757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8023    1.2338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8560    0.9291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8560   -0.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1949   -0.1587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9900   -0.5709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9900    1.4291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0904    2.0114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8994   -1.7410    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1240   -0.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1240    0.9291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8994    2.5992    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.8129   -1.3343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7949   -2.7356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7768   -4.1368    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.8129    2.1924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5858   -4.7246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8632   -4.5436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8452   -5.9448    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.6220   -1.9221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6039    4.1815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4813   -5.7191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4994   -4.3179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0362   -5.3570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4994    5.1760    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7406   -6.9393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1226   -5.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1407   -4.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3084    5.7638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2038    6.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7226   -8.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0129    7.3461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2903    7.1650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8090   -8.7473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9083    8.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1858    8.1595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9948    8.7473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3396    1.5430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5512    1.8007    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5512   -0.9426    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3396   -0.6849    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7613    0.7647    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9900    2.0491    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9900   -1.1909    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5240   -1.4054    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3330   -1.9932    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5871    1.2391    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5871   -0.3809    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3330    2.8513    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2589   -0.9036    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4662   -0.8203    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3432   -3.8846    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3797   -2.7779    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0194   -4.9768    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5608    1.6260    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3793    1.9402    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0651    2.7588    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2285    3.8458    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3468   -6.3092    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8647   -5.6543    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4165   -6.3357    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0979   -5.7839    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7515   -4.8843    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0658   -4.0657    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2472   -3.7515    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6026   -5.1048    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2603   -5.9025    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9978    4.8116    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7573   -4.4273    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2055   -3.7459    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5241   -4.2977    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8704   -5.1974    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5562   -6.0159    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3748   -6.3302    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5802    5.2065    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9044    5.9347    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0371   -1.8798    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0842    5.2183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5210    6.1993    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3255   -6.9816    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8726   -8.9422    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3410   -8.2973    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5793    7.0939    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7887    6.8006    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4099    8.7050    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6194    8.4117    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1381   -9.9940    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2061  -10.1063    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3918   10.1063    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 24  2  0  0  0  0
  2 27  2  0  0  0  0
  3 33  2  0  0  0  0
  4 39  1  0  0  0  0
  4 96  1  0  0  0  0
  5 37  2  0  0  0  0
  6 39  2  0  0  0  0
  7 40  2  0  0  0  0
  8 45  2  0  0  0  0
  9 53  2  0  0  0  0
 10 56  1  0  0  0  0
 10108  1  0  0  0  0
 11 19  1  0  0  0  0
 11 27  1  0  0  0  0
 11 61  1  0  0  0  0
 12 24  1  0  0  0  0
 28 12  1  1  0  0  0
 12 64  1  0  0  0  0
 13 33  1  0  0  0  0
 34 13  1  1  0  0  0
 13 72  1  0  0  0  0
 31 14  1  6  0  0  0
 14 40  1  0  0  0  0
 14 77  1  0  0  0  0
 15 37  1  0  0  0  0
 38 15  1  6  0  0  0
 15 86  1  0  0  0  0
 44 16  1  1  0  0  0
 16 97  1  0  0  0  0
 16 98  1  0  0  0  0
 17 45  1  0  0  0  0
 17 50  1  0  0  0  0
 17 99  1  0  0  0  0
 18 53  1  0  0  0  0
 18106  1  0  0  0  0
 18107  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 24  1  0  0  0  0
 20 23  1  0  0  0  0
 20 59  1  0  0  0  0
 20 60  1  0  0  0  0
 21 22  1  0  0  0  0
 21 57  1  0  0  0  0
 21 58  1  0  0  0  0
 22 23  1  0  0  0  0
 22 26  2  0  0  0  0
 23 25  2  0  0  0  0
 25 29  1  0  0  0  0
 25 63  1  0  0  0  0
 26 30  1  0  0  0  0
 26 62  1  0  0  0  0
 27 31  1  0  0  0  0
 28 32  1  0  0  0  0
 28 33  1  0  0  0  0
 28 65  1  0  0  0  0
 29 30  2  0  0  0  0
 29 67  1  0  0  0  0
 30 66  1  0  0  0  0
 31 35  1  0  0  0  0
 31 68  1  0  0  0  0
 32 39  1  0  0  0  0
 32 69  1  0  0  0  0
 32 70  1  0  0  0  0
 34 36  1  0  0  0  0
 34 37  1  0  0  0  0
 34 71  1  0  0  0  0
 35 74  1  0  0  0  0
 35 75  1  0  0  0  0
 35 76  1  0  0  0  0
 36 41  1  0  0  0  0
 36 42  1  0  0  0  0
 36 73  1  0  0  0  0
 38 43  1  0  0  0  0
 38 45  1  0  0  0  0
 38 78  1  0  0  0  0
 40 44  1  0  0  0  0
 41 79  1  0  0  0  0
 41 80  1  0  0  0  0
 41 81  1  0  0  0  0
 42 82  1  0  0  0  0
 42 83  1  0  0  0  0
 42 84  1  0  0  0  0
 43 46  1  0  0  0  0
 43 47  1  0  0  0  0
 43 85  1  0  0  0  0
 44 48  1  0  0  0  0
 44 87  1  0  0  0  0
 46 91  1  0  0  0  0
 46 92  1  0  0  0  0
 46 93  1  0  0  0  0
 47 88  1  0  0  0  0
 47 89  1  0  0  0  0
 47 90  1  0  0  0  0
 48 49  1  0  0  0  0
 48 94  1  0  0  0  0
 48 95  1  0  0  0  0
 49 51  2  0  0  0  0
 49 52  1  0  0  0  0
 50 53  1  0  0  0  0
 50100  1  0  0  0  0
 50101  1  0  0  0  0
 51 54  1  0  0  0  0
 51102  1  0  0  0  0
 52 55  2  0  0  0  0
 52103  1  0  0  0  0
 54 56  2  0  0  0  0
 54104  1  0  0  0  0
 55 56  1  0  0  0  0
 55105  1  0  0  0  0
M  END

$$$$