
     RDKit          3D

 66 69  0  0  0  0  0  0  0  0999 V2000
    7.4857    0.9092   -0.5795 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9119   -0.3877   -0.5920 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6016   -0.6469   -0.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7323   -1.3375   -1.0246 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4057   -1.5702   -0.6535 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9303   -1.1411    0.5968 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4662   -1.3203    0.9458 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6209   -0.4249    0.1220 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8088    1.0415    0.4866 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1906    1.9528   -0.7113 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0346    2.3901   -1.4584 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8021    3.4850   -1.1178 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3116    4.7982   -1.1879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1594    5.8874   -0.9674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5071    5.6770   -0.6540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0218    4.3763   -0.5453 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1849    3.2763   -0.7989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5486    1.8544   -0.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9485    1.2007   -0.4416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8562   -0.3763   -0.6278 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2839   -1.2725    0.5508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8163   -1.9556    0.3882 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9111   -3.0379   -0.7472 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7087   -4.3071   -0.3781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5263   -4.7502    1.0191 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3396   -4.1739    1.6745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4659   -2.6444    1.7737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8301   -0.7893   -0.0945 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8171   -0.4889    1.4799 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1406   -0.2361    1.0957 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7621    1.6681   -0.9538 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3893    0.9195   -1.2272 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7977    1.1786    0.4495 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0754   -1.6728   -1.9962 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7387   -2.0813   -1.3415 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3067   -1.1117    2.0247 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2171   -2.3860    0.7451 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5854    1.1560    1.2668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0605    1.5183    0.9952 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8894    1.3969   -1.3805 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7317    2.8422   -0.3053 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7249    4.9672   -1.4673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7654    6.8988   -1.0499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1443    6.5314   -0.4652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0529    4.2491   -0.2364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9691    1.2422   -1.1247 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2154    1.8360    0.6344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4993    1.4198    0.5009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5126    1.6249   -1.3044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9145   -0.7169   -0.7616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3676   -0.6129   -1.5978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2998   -0.6776    1.4858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0285   -2.0660    0.7829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3604   -2.6123   -1.6709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8795   -3.3483   -1.0272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4160   -5.1318   -1.0644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7900   -4.1459   -0.5854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3721   -4.4914    1.5811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4223   -4.4622    1.1122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2423   -4.6092    2.7012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2557   -2.4533    2.5346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5710   -2.2390    2.2881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9626   -0.7403   -1.2033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3182   -0.0189    0.4576 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4778   -0.1469    2.4585 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7997    0.2878    1.7796 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  1  0
 19 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
 26 27  1  0
 22 28  1  0
  6 29  1  0
 29 30  2  0
 30  3  1  0
 28  8  1  0
 17 12  1  0
 27 22  1  0
  1 31  1  0
  1 32  1  0
  1 33  1  0
  4 34  1  0
  5 35  1  0
  7 36  1  0
  7 37  1  0
  9 38  1  0
  9 39  1  0
 10 40  1  0
 10 41  1  0
 13 42  1  0
 14 43  1  0
 15 44  1  0
 16 45  1  0
 18 46  1  0
 18 47  1  0
 19 48  1  0
 19 49  1  0
 20 50  1  0
 20 51  1  0
 21 52  1  0
 21 53  1  0
 23 54  1  0
 23 55  1  0
 24 56  1  0
 24 57  1  0
 25 58  1  0
 26 59  1  0
 26 60  1  0
 27 61  1  0
 27 62  1  0
 28 63  1  0
 28 64  1  0
 29 65  1  0
 30 66  1  0
M  END
$$$$
