
     RDKit          3D

 60 61  0  0  0  0  0  0  0  0999 V2000
    2.7395    2.5713    1.0568 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9239    1.5449    0.8264 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9830    1.1373    1.8263 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2718    1.7946    2.0445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8705    1.6169    3.1392 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9016    2.6825    0.9959 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.5774    4.1486    1.3089 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3587    2.4468    0.9395 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2021    3.3988    1.4158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9528    1.2133    0.4729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2049    1.0936    0.5572 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1435    0.0752   -0.1440 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.3306   -0.0333   -1.6823 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4623   -1.0119   -2.1920 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7417   -0.3304   -2.1231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6726    0.7306   -2.3399 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1050   -1.5215   -2.3184 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3571   -1.2103    0.5676 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6941   -1.7618    0.8259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2505   -1.8829    1.2045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3872   -2.3193    2.3794 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0207   -2.1978    0.4580 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1048   -3.5741   -0.1993 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1174   -2.1933    1.3760 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4664   -1.9955    1.0439 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3077   -2.0093    1.9812 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9304   -1.6466   -0.3585 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2722   -2.2925   -0.7280 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0653   -1.2095   -1.4574 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4322    0.1196   -1.0628 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1511   -0.2153   -0.4704 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0863    0.7346   -0.3842 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2815    0.8667   -1.3443 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4905    2.8604    0.3300 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6641    3.1339    1.9787 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2844    0.4062    2.5051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4717    2.4746   -0.0049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9488    4.4302    2.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0471    4.8123    0.5521 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5194    4.3160    1.2756 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4366    3.9521    0.6270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0814    0.3397   -0.0262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0413    0.9555   -2.1124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3414   -0.8186   -3.1580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3879    1.7272   -2.2123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6548    0.5179   -2.6247 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9645   -1.6021    1.8918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6977   -2.8497    0.6098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4744   -1.2931    0.2009 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1840   -1.4346   -0.3222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2641   -4.3587    0.5731 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8195   -3.8208   -0.7625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9610   -3.5835   -0.9100 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1900   -1.9552   -1.1235 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1206   -3.1805   -1.3797 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8482   -2.6128    0.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1412   -1.2415   -1.1789 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9700   -1.3565   -2.5554 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0596    0.6488   -0.3139 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2931    0.7632   -1.9601 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  6  8  1  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 15 17  2  0
 12 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  2  0
 32  2  1  0
 31 27  1  0
  1 34  1  0
  1 35  1  0
  3 36  1  0
  6 37  1  6
  7 38  1  0
  7 39  1  0
  7 40  1  0
  9 41  1  0
 12 42  1  6
 13 43  1  6
 14 44  1  0
 16 45  1  0
 16 46  1  0
 19 47  1  0
 19 48  1  0
 19 49  1  0
 22 50  1  6
 23 51  1  0
 23 52  1  0
 23 53  1  0
 27 54  1  6
 28 55  1  0
 28 56  1  0
 29 57  1  0
 29 58  1  0
 30 59  1  0
 30 60  1  0
M  END
$$$$
