
     RDKit          3D

 69 72  0  0  0  0  0  0  0  0999 V2000
   -4.2249    2.2135    1.0479 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6098    1.1143    1.0333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1532    1.0855    1.4546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1576    0.9303    0.3460 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6127    1.4046   -0.9849 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9235    2.8797   -0.9838 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9889    3.8007   -0.4817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2620    5.1712   -0.5168 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4637    5.6330   -1.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3883    4.7247   -1.5830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1156    3.3540   -1.5577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6482   -0.4574    0.3108 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4245   -0.7171   -0.7336 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0936   -1.4789   -1.8822 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0917   -1.8536   -2.7887 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4120   -1.4630   -2.5824 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7487   -0.6973   -1.4681 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7748   -0.3290   -0.5260 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2086    0.4559    0.6551 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5380    1.4638    1.0094 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4301    0.1391    1.3493 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2200    1.2313    1.9380 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5834    0.7372    2.4435 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1737   -0.2753    1.4576 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2788   -1.5307    1.3048 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3769   -2.0282   -0.0075 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7945   -1.2558    1.6381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2386   -1.8233   -2.1436 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7125   -3.1697   -2.2098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3504   -3.5703   -0.8691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5698   -2.6829   -0.5218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7022   -2.4299    1.0006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5964   -1.2256    1.3399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2867   -0.0452    0.5245 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0388    0.2980    2.2346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9216    2.0374    1.9818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8081    1.2732   -1.7375 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4766    0.8021   -1.3398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0493    3.4561   -0.0683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5370    5.8740   -0.1298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6722    6.6954   -1.0859 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3143    5.0814   -2.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8383    2.6642   -1.9765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2298   -0.7346    1.3026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4903   -1.1290    0.1404 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8358   -2.4320   -3.6670 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1771   -1.7451   -3.2926 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7761   -0.3840   -1.3423 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3925    2.0101    1.1612 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6578    1.6919    2.7791 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2763    1.6009    2.5534 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4689    0.2610    3.4447 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1839   -0.5838    1.8064 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3018    0.2234    0.4701 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6381   -2.3137    2.0179 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2832   -2.4249   -0.0993 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1403   -1.9711    1.0934 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6303   -1.4412    2.7226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4754   -3.2393   -3.0136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8843   -3.8701   -2.4562 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6757   -4.6332   -0.9222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5663   -3.5067   -0.0831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5008   -3.1644   -0.9004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4799   -1.7149   -1.0615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7179   -2.2767    1.4858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1378   -3.3383    1.4735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5055   -0.9818    2.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6551   -1.5153    1.1565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9314    0.1256   -0.2830 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
  4 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 25 27  1  0
 14 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34  2  1  0
 11  6  1  0
 18 13  1  0
 27 21  1  0
  3 35  1  0
  3 36  1  0
  5 37  1  0
  5 38  1  0
  7 39  1  0
  8 40  1  0
  9 41  1  0
 10 42  1  0
 11 43  1  0
 12 44  1  0
 12 45  1  0
 15 46  1  0
 16 47  1  0
 17 48  1  0
 22 49  1  0
 22 50  1  0
 23 51  1  0
 23 52  1  0
 24 53  1  0
 24 54  1  0
 25 55  1  0
 26 56  1  0
 27 57  1  0
 27 58  1  0
 29 59  1  0
 29 60  1  0
 30 61  1  0
 30 62  1  0
 31 63  1  0
 31 64  1  0
 32 65  1  0
 32 66  1  0
 33 67  1  0
 33 68  1  0
 34 69  1  0
M  END
$$$$
