
     RDKit          3D

 63 66  0  0  0  0  0  0  0  0999 V2000
    4.6727   -1.1534    1.7321 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2245   -0.2024    0.7194 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5450    0.0184    0.5669 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6863    0.9487   -0.3638 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9721    1.4681   -0.8087 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4820    1.3428   -0.8163 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5154    0.6114   -0.1566 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0576    0.7449   -0.3330 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5807    1.8816   -0.5874 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1781   -0.3904   -0.2522 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5461   -1.6656   -0.8702 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3833   -2.1835   -1.7086 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0908   -2.2258   -0.8792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2820   -0.8692   -0.1917 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7821    0.1286   -1.2931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9241    1.6146   -0.8830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9283    2.3723   -1.7856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0319    3.1142   -1.0068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8200    2.2380   -0.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9607    0.9063   -0.5111 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6799   -0.0884    0.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7462   -0.6942   -0.5144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5370   -1.6536    0.1218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2633   -2.0232    1.4387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1841   -1.4513    2.1158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3671   -0.5009    1.4810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1810   -0.0017    2.2051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3353    0.5058    3.3487 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8587   -0.0863    1.6491 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4434   -1.2082    0.8038 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9671   -0.3394    0.5772 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6346   -0.8780    2.0078 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2932   -1.1192    2.6506 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6954   -2.1858    1.3249 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0461    2.5474   -0.5603 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8009    0.9247   -0.3067 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0698    1.3366   -1.9073 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3204    2.0994   -1.5735 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7849   -2.4077   -0.0784 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4387   -1.5505   -1.5247 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2588   -1.5529   -2.6131 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6218   -3.2106   -2.0604 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2278   -3.0151   -0.1060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7424   -2.5642   -1.5340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0957    0.1186   -2.1637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7558   -0.2551   -1.6702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1983    1.7226    0.1767 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0667    2.1048   -0.9749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3721    3.1220   -2.3887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4137    1.6981   -2.5234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5824    3.9671   -0.4536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7439    3.5417   -1.7462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3025    2.2454    0.9598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8271    2.6813    0.1363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9758   -0.4005   -1.5311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3680   -2.1050   -0.4039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8797   -2.7643    1.9302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9673   -1.7719    3.1274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1137    0.4221    2.1750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3096   -1.5931    0.2246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1305   -2.0334    1.4806 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1395   -0.9736    1.4750 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8034    0.6910    0.9529 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  4  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 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  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  2  0
 27 29  1  0
 29 30  1  0
 14 31  1  0
  7  2  1  0
 31 10  1  0
 30 14  1  0
 26 21  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  5 35  1  0
  5 36  1  0
  5 37  1  0
  6 38  1  0
 11 39  1  0
 11 40  1  0
 12 41  1  0
 12 42  1  0
 13 43  1  0
 13 44  1  0
 15 45  1  0
 15 46  1  0
 16 47  1  0
 16 48  1  0
 17 49  1  0
 17 50  1  0
 18 51  1  0
 18 52  1  0
 19 53  1  0
 19 54  1  0
 22 55  1  0
 23 56  1  0
 24 57  1  0
 25 58  1  0
 29 59  1  0
 30 60  1  0
 30 61  1  0
 31 62  1  0
 31 63  1  0
M  END
$$$$
