
     RDKit          3D

 64 67  0  0  0  0  0  0  0  0999 V2000
    4.2204    2.6886    2.9573 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3227    2.5058    1.4505 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4350    1.0884    1.1200 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4078    0.2458    0.9021 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9294   -1.0159    0.6745 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2420   -2.3068    0.4326 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7431   -3.3346    0.9658 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1143   -2.4577   -0.4662 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9778   -3.7511   -1.1506 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6481   -3.8888   -1.8751 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3479   -2.7224   -2.6069 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0681   -1.6126   -1.7632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1531   -0.4173   -2.7526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3236    0.9973   -2.1448 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7909    1.3406   -1.8492 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9394    2.5717   -0.9378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2589    2.5234   -0.2069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3992    3.0041   -0.8771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6478    3.0026   -0.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7770    2.5250    1.0484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6607    2.0323    1.7251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4016    1.9978    1.1093 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3399    1.4733    1.8676 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4674    0.4103    1.4739 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2372   -0.8559    1.0902 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3312   -1.8259    0.4551 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8661   -2.9764    1.2341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2373   -1.8659   -0.9859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2749   -2.1524   -1.6436 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2991   -1.2931   -0.8498 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2978   -0.8586    0.8115 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5809    0.4304    1.0795 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3268    2.1569    3.3464 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1289    2.2849    3.4526 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1292    3.7700    3.1970 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4221    2.9381    0.9631 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2131    3.0508    1.0723 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3718    0.5386    0.9640 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0511   -4.5842   -0.4160 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8092   -3.8578   -1.8818 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7282   -4.7314   -2.5933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1641   -4.1715   -1.1761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0106   -0.6368   -3.4272 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7351   -0.3736   -3.4224 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3112    1.1206   -1.2463 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0480    1.7423   -2.8834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3249    1.5302   -2.8053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2878    0.4752   -1.3865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1077    2.6789   -0.2132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8896    3.4875   -1.5668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3201    3.3867   -1.8876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5161    3.3776   -0.7812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7454    2.5302    1.5323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7772    1.6569    2.7338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8011    0.7260    0.6619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8050    0.1695    2.3338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0842   -0.6209    0.4125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6938   -1.2839    2.0089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0466   -2.8266    2.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4029   -3.8934    0.9105 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2212   -3.1206    1.1036 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9763   -0.5832   -1.3717 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9340   -0.8009    0.0686 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0426   -1.6377    0.7253 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 26 28  1  0
 28 29  2  0
 12 30  1  0
  5 31  1  0
 31 32  2  0
 32  3  1  0
 30  8  1  0
 28 12  1  0
 22 17  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  2 36  1  0
  2 37  1  0
  4 38  1  0
  9 39  1  0
  9 40  1  0
 10 41  1  0
 10 42  1  0
 13 43  1  0
 13 44  1  0
 14 45  1  0
 14 46  1  0
 15 47  1  0
 15 48  1  0
 16 49  1  0
 16 50  1  0
 18 51  1  0
 19 52  1  0
 20 53  1  0
 21 54  1  0
 24 55  1  0
 24 56  1  0
 25 57  1  0
 25 58  1  0
 27 59  1  0
 27 60  1  0
 27 61  1  0
 30 62  1  0
 30 63  1  0
 31 64  1  0
M  END
$$$$
