
     RDKit          3D

 81 83  0  0  0  0  0  0  0  0999 V2000
   -7.2703   -0.3877   -1.1245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4798    0.4619   -0.1185 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3536    1.8985   -0.6436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1059   -0.1974    0.1613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3123    0.4454    1.3288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3239   -0.5302    2.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7659   -1.4361    1.0603 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0096   -2.5863    1.3367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1587   -3.6562    0.4442 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4720   -4.8548    0.6399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6188   -4.9990    1.7315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4343   -3.9374    2.6175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1020   -2.7151    2.4242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7840   -1.6225    3.3644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0435   -1.7899    4.5880 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1093   -0.4187    2.9591 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3271   -0.1121    1.5917 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7812   -0.4657    1.4240 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5828   -0.3025    2.3842 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2596   -0.9376    0.1555 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6707   -1.2178   -0.0994 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4562    0.0886   -0.2562 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9288   -0.1914   -0.5776 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7348    1.1123   -0.6832 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1775    0.8219   -0.8390 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9852    1.9545   -0.3520 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5140    0.5500   -2.2484 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0810    1.3818    1.3070 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3304    1.7470   -0.1323 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4776    2.1640   -0.4515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6853    1.6191   -1.1504 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3945    1.9095   -2.5458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6851    1.6515   -3.3075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5615    0.8246   -2.3727 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0293    1.0761   -0.9570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9030    2.0606   -0.2122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9254    3.2547   -0.6154 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6657    1.7241    0.9680 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2724    0.0561   -1.3041 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4222   -1.4154   -0.7277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7299   -0.4520   -2.0939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0649    0.4892    0.8267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3518    2.2883   -0.9381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6828    1.9398   -1.5277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9644    2.5702    0.1465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4982   -0.2257   -0.7621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3032   -1.2582    0.4342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0591    0.6799    2.1215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8661   -1.1196    2.7799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5411    0.0614    2.5124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8258   -3.5597   -0.4041 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6043   -5.6734   -0.0557 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0882   -5.9303    1.8843 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2548   -4.0605    3.4448 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1693    0.2449    3.7175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2578   -0.7041    0.8653 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5729   -1.1131   -0.6133 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0902   -1.8282    0.7304 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7570   -1.8093   -1.0363 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3870    0.6753    0.6852 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0078    0.6891   -1.0775 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9852   -0.7496   -1.5370 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3670   -0.8250    0.2253 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5571    1.6884    0.2545 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3518    1.7325   -1.5270 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0676    1.7219   -0.4434 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7871    2.1314    0.7282 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7603    2.8850   -0.9213 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5952    0.3104   -2.3437 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9571   -0.3346   -2.6193 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2820    1.4228   -2.8979 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7409    1.9974    1.9575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9568    1.6483    1.5837 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4087    1.2316   -2.9086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0760    2.9693   -2.6619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1870    2.6188   -3.5293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4934    1.1150   -4.2622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6307    1.0995   -2.4973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4460   -0.2539   -2.6232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9571    0.1205   -0.4291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9332    2.5380    1.5666 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  2  0
 18 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
 25 27  1  0
 17 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
 34 35  1  0
 35 36  1  0
 36 37  2  0
 36 38  1  0
 38  5  1  0
 13  8  1  0
 35 31  1  0
  1 39  1  0
  1 40  1  0
  1 41  1  0
  2 42  1  0
  3 43  1  0
  3 44  1  0
  3 45  1  0
  4 46  1  0
  4 47  1  0
  5 48  1  0
  6 49  1  0
  6 50  1  0
  9 51  1  0
 10 52  1  0
 11 53  1  0
 12 54  1  0
 16 55  1  0
 17 56  1  0
 20 57  1  0
 21 58  1  0
 21 59  1  0
 22 60  1  0
 22 61  1  0
 23 62  1  0
 23 63  1  0
 24 64  1  0
 24 65  1  0
 26 66  1  0
 26 67  1  0
 26 68  1  0
 27 69  1  0
 27 70  1  0
 27 71  1  0
 28 72  1  0
 28 73  1  0
 32 74  1  0
 32 75  1  0
 33 76  1  0
 33 77  1  0
 34 78  1  0
 34 79  1  0
 35 80  1  0
 38 81  1  0
M  END
$$$$
