
     RDKit          3D

 76 79  0  0  0  0  0  0  0  0999 V2000
   -3.6440    1.5913   -2.8209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7720    2.4691   -1.9183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4500    1.7978   -0.6448 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1056    2.3089    0.5792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5832    1.9236    0.6177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6748    0.5137    0.7652 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7962   -0.2780    0.4846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0318    0.2748    0.1000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1043   -0.5606   -0.2212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9573   -1.9477   -0.1573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7406   -2.5062    0.2423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6569   -1.6778    0.5761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3506   -2.2759    1.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2310   -2.0889    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8274   -2.0987    0.6343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4536   -0.7804    1.3725 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6470    0.2820    0.5616 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7327   -0.3214    0.1568 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6606    0.7101   -0.3210 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8847    0.3399   -0.9931 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4246    1.1486   -1.7977 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5485   -0.9969   -0.7768 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9819   -0.8184   -0.4689 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6987   -2.1041   -0.5522 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2213   -1.8709   -0.5298 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6303   -0.6175    0.2838 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8268    0.6047   -0.5864 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8193    1.5727   -0.2451 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0856    0.8075   -1.5857 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6119   -0.3316    1.3995 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1690   -0.1900    0.8636 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2318    2.1093   -0.3438 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3409    2.4484    0.8662 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3833    1.3655    1.4424 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4703    0.7197   -0.6599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2669    0.1069   -1.7443 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0379    0.8079   -3.3174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0989    2.2182   -3.6171 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4570    1.1060   -2.2431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3173    3.4208   -1.7304 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8334    2.7397   -2.4498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0159    3.4165    0.6135 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6387    1.9317    1.5037 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0828    2.2644   -0.3125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0781    2.4143    1.4823 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1726    1.3458    0.0437 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0507   -0.1316   -0.5239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7885   -2.5909   -0.4136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6466   -3.5838    0.2954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0815   -1.7986    2.0108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4660   -3.3612    1.2599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2981   -2.9264   -0.7279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3684   -1.1592   -0.5860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0917   -2.3422   -0.1546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7773   -2.9409    1.3598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8472   -1.0578    2.2630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3651   -0.3121    1.7917 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6232   -1.0920   -0.6333 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1843   -0.8068    1.0489 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4282   -1.5676   -1.7234 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0562   -1.5882    0.0235 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4466   -2.6371   -1.4961 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4044   -2.7649    0.2959 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7011   -2.7686   -0.0815 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6066   -1.7969   -1.5710 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6073   -0.8400    0.7671 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4138    1.4529    0.6052 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9513    2.4225   -0.8377 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9009    0.5844    1.9611 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6435   -1.1764    2.1233 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4681   -0.6207    1.6150 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9391    0.8945    0.7777 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1143    2.7862   -0.3300 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6797    2.3038   -1.2882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3668    3.2559    0.5846 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9900    2.8684    1.6635 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  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 27 29  2  0
 26 30  1  0
 30 31  1  0
 19 32  1  0
 32 33  1  0
 33 34  1  0
 17 35  1  0
 35 36  2  0
 35  3  1  0
 12  7  1  0
 34 17  1  0
 31 23  1  0
  1 37  1  0
  1 38  1  0
  1 39  1  0
  2 40  1  0
  2 41  1  0
  4 42  1  0
  4 43  1  0
  5 44  1  0
  5 45  1  0
  8 46  1  0
  9 47  1  0
 10 48  1  0
 11 49  1  0
 13 50  1  0
 13 51  1  0
 14 52  1  0
 14 53  1  0
 15 54  1  0
 15 55  1  0
 16 56  1  0
 16 57  1  0
 18 58  1  0
 18 59  1  0
 22 60  1  0
 22 61  1  0
 24 62  1  0
 24 63  1  0
 25 64  1  0
 25 65  1  0
 26 66  1  0
 28 67  1  0
 28 68  1  0
 30 69  1  0
 30 70  1  0
 31 71  1  0
 31 72  1  0
 32 73  1  0
 32 74  1  0
 33 75  1  0
 33 76  1  0
M  END
$$$$
