B0UA6J
  -OEChem-04012117092D

 86 89  0     1  0  0  0  0  0999 V2000
    7.2755   -2.5067    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4802    0.6307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0076   -2.5001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6038    0.0424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0925    3.0529    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.4609    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9911    0.0914    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.8572    0.5914    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.1251    0.5914    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.8572    1.5914    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.2151    0.0846    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.2071   -0.9570    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.8034    1.8961    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1251    1.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9911    2.0914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0072   -0.9501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8034    0.2867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1092   -1.4779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3870    1.0914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2883    0.6486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2717   -1.5068    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.8572    2.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2228    1.0845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1140    2.8467    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.3404    0.1207    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.3320   -0.9643    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.4462    3.5910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4032    4.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7604    2.3086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1435   -3.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6000   -0.9576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1473   -4.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -1.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7282   -2.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8680   -0.9509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.4476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7305   -0.3279    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9471   -0.2538    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8612    1.0164    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2104   -1.8070    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6431    2.0280    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9131    2.1740    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5145    1.4837    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3897    2.5664    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5926    2.5664    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2252   -1.5305    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6163   -0.8346    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.5523   -0.2802    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3408   -0.0225    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7118   -1.9538    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5101   -1.9507    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8479    0.6767    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8479    1.5061    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965    1.1153    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8984    1.1307    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7353   -1.8178    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4772    2.5914    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8572    3.2114    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2372    2.5914    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8428    1.0798    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2276    1.7045    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6028    1.0893    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3067    3.4360    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3488    0.7406    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7969   -0.6512    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9077    4.0050    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0321    4.0524    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9847    3.1769    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4617   -2.0809    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4874    1.2506    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9925    3.8108    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5958    4.5927    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.8139    4.1960    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2989    1.8945    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.1745    1.8471    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2219    2.7226    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5273   -4.0058    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1497   -4.6234    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7673   -4.0010    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1082   -2.4518    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7258   -3.0742    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3482   -2.4566    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8703   -0.3309    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6921   -0.9094    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4619   -1.7555    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3079   -1.9857    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
 21  1  1  1  0  0  0
  1 30  1  0  0  0  0
 25  2  1  1  0  0  0
  2 70  1  0  0  0  0
  3 30  2  0  0  0  0
  4 31  2  0  0  0  0
 24  5  1  6  0  0  0
  5 28  1  0  0  0  0
  5 29  1  0  0  0  0
 26  6  1  1  0  0  0
  6 31  1  0  0  0  0
  6 69  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 16  1  0  0  0  0
  7 37  1  1  0  0  0
  8 10  1  0  0  0  0
  8 17  1  0  0  0  0
  8 38  1  6  0  0  0
  9 11  1  0  0  0  0
  9 14  1  0  0  0  0
  9 39  1  6  0  0  0
 10 13  1  0  0  0  0
 10 15  1  0  0  0  0
 10 22  1  1  0  0  0
 11 12  1  0  0  0  0
 11 20  1  0  0  0  0
 11 23  1  1  0  0  0
 12 18  1  0  0  0  0
 12 21  1  0  0  0  0
 12 40  1  6  0  0  0
 13 19  1  0  0  0  0
 13 24  1  0  0  0  0
 13 41  1  6  0  0  0
 14 15  1  0  0  0  0
 14 42  1  0  0  0  0
 14 43  1  0  0  0  0
 15 44  1  0  0  0  0
 15 45  1  0  0  0  0
 16 18  1  0  0  0  0
 16 46  1  0  0  0  0
 16 47  1  0  0  0  0
 17 19  1  0  0  0  0
 17 48  1  0  0  0  0
 17 49  1  0  0  0  0
 18 50  1  0  0  0  0
 18 51  1  0  0  0  0
 19 52  1  0  0  0  0
 19 53  1  0  0  0  0
 20 25  1  0  0  0  0
 20 54  1  0  0  0  0
 20 55  1  0  0  0  0
 21 26  1  0  0  0  0
 21 56  1  0  0  0  0
 22 57  1  0  0  0  0
 22 58  1  0  0  0  0
 22 59  1  0  0  0  0
 23 60  1  0  0  0  0
 23 61  1  0  0  0  0
 23 62  1  0  0  0  0
 24 27  1  0  0  0  0
 24 63  1  0  0  0  0
 25 26  1  0  0  0  0
 25 64  1  0  0  0  0
 26 65  1  0  0  0  0
 27 66  1  0  0  0  0
 27 67  1  0  0  0  0
 27 68  1  0  0  0  0
 28 71  1  0  0  0  0
 28 72  1  0  0  0  0
 28 73  1  0  0  0  0
 29 74  1  0  0  0  0
 29 75  1  0  0  0  0
 29 76  1  0  0  0  0
 30 32  1  0  0  0  0
 31 33  1  0  0  0  0
 32 77  1  0  0  0  0
 32 78  1  0  0  0  0
 32 79  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  2  0  0  0  0
 34 80  1  0  0  0  0
 34 81  1  0  0  0  0
 34 82  1  0  0  0  0
 35 36  1  0  0  0  0
 35 83  1  0  0  0  0
 36 84  1  0  0  0  0
 36 85  1  0  0  0  0
 36 86  1  0  0  0  0
M  END

$$$$