
     RDKit          3D

 94 99  0  0  0  0  0  0  0  0999 V2000
   -6.4120    5.3582    1.6213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4376    4.2551    1.3708 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2478    3.3814    2.2600 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7435    4.1855    0.1129 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7572    3.1497   -0.2312 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.6264    3.0985    0.8345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2467    3.0857    0.2337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1490    2.4331    0.7532 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9199    2.7595    0.0011 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4573    3.6300   -0.9196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8657    3.8607   -0.8018 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2990    2.3802    0.1799 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7322    1.1730    0.5434 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6778   -0.1821    1.1036 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.1242   -0.7300   -0.5472 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9166   -1.9501   -1.0477 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.7239   -2.2042   -2.4857 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5611   -1.8724   -3.2689 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7266   -1.3488   -4.4035 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8382   -2.2448   -2.8408 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.2996   -3.5001   -3.5944 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5847   -3.8774   -3.1810 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7613   -1.1332   -3.0945 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7945    0.0106   -2.2318 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1406    1.0370   -2.5587 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6858    0.0766   -1.0129 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.0665   -1.3111   -0.4515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9871   -1.2022    0.7368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3439   -1.5505    0.6205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2050   -1.3986    1.7112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7211   -0.8943    2.9214 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3727   -0.5504    3.0464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5063   -0.7070    1.9600 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8908    0.8397   -1.3477 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4434    1.8166   -0.4546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5569    1.5804    0.0862 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6764   -3.2051   -0.2415 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5394   -3.7445   -0.2642 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7230   -3.8475    0.5102 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9005   -3.1673    1.0797 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4071   -3.9659    2.2890 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0104   -3.0340    0.0599 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8738   -3.5572   -1.0800 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2825   -2.4572    0.4043 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5335   -1.0517    0.7675 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.4753   -0.1343   -0.4504 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7696    0.2141   -0.9698 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.2333    1.0945    0.5521 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.6810    0.4395    1.7927 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6964   -0.5693    1.9215 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9285   -1.0448    3.0652 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6383    2.5929    0.5049 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8433    3.0813    1.7878 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.7771    2.8322   -0.2447 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.4308    3.2982   -0.1227 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5857    3.4122   -1.4941 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.2242    4.5485    0.4362 F   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3201    5.1898    1.0087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6971    5.3946    2.6943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9556    6.3284    1.3394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9434    4.9246   -0.5991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3258    3.4338   -1.2152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6727    3.9987    1.4837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7588    2.2201    1.5017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1341    1.8241    1.6460 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0741    4.1076   -1.6680 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2070    0.1031   -1.2770 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0572   -0.9829   -0.4406 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9722   -1.6917   -0.9241 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5936   -2.4081   -3.0294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8472   -2.4920   -1.7721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3272   -3.2974   -4.6860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5827   -4.3367   -3.4249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4817   -4.3151   -2.2945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0437   -0.9643   -4.0874 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1125    0.6006   -0.2232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5409   -1.9275   -1.2472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1552   -1.8413   -0.1116 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7385   -1.9247   -0.3156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2504   -1.6631    1.6152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3944   -0.7725    3.7603 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9985   -0.1564    3.9830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4649   -0.4283    2.0680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5378    0.4238   -2.0570 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5433   -4.8398    0.7897 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6021   -2.1666    1.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6974   -4.9931    1.9819 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2885   -3.4803    2.7520 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6055   -4.0361    3.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1143   -2.9755    0.0427 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5880   -0.9990    1.1235 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0086   -0.6133   -1.2998 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0123    0.8086   -0.2252 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2349    0.7589    2.6844 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
  9 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  1  0
 15 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
 20 23  1  0
 23 24  1  0
 24 25  2  0
 24 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 32 33  2  0
 26 34  1  0
 34 35  1  0
 35 36  2  0
 16 37  1  0
 37 38  2  0
 37 39  1  0
 39 40  1  0
 40 41  1  0
 40 42  1  0
 42 43  2  0
 42 44  1  0
 44 45  1  0
 45 46  1  0
 46 47  1  0
 47 48  1  0
 48 49  1  0
 49 50  1  0
 50 51  2  0
 48 52  1  6
 52 53  1  0
 52 54  1  0
 52 55  1  0
 55 56  1  0
 55 57  1  0
 35  5  1  0
 50 45  1  0
 11  7  1  0
 55 12  1  0
 48 13  1  0
 33 28  1  0
  1 58  1  0
  1 59  1  0
  1 60  1  0
  4 61  1  0
  5 62  1  6
  6 63  1  0
  6 64  1  0
  8 65  1  0
 10 66  1  0
 15 67  1  0
 15 68  1  0
 16 69  1  6
 17 70  1  0
 20 71  1  1
 21 72  1  0
 21 73  1  0
 22 74  1  0
 23 75  1  0
 26 76  1  1
 27 77  1  0
 27 78  1  0
 29 79  1  0
 30 80  1  0
 31 81  1  0
 32 82  1  0
 33 83  1  0
 34 84  1  0
 39 85  1  0
 40 86  1  0
 41 87  1  0
 41 88  1  0
 41 89  1  0
 44 90  1  0
 45 91  1  1
 46 92  1  0
 46 93  1  0
 49 94  1  0
M  END
$$$$
