B4PK8D
  -OEChem-04042104043D

 59 63  0     1  0  0  0  0  0999 V2000
    7.2280   -0.1545   -1.0373 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.4378   -1.8513    0.0583 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.8489    0.0140    1.0971 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2966   -0.1879   -2.1384 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9455    1.3421   -0.5081 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1131    1.2363   -1.1482 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2108   -0.7224   -1.3628 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9997   -0.0388   -1.7616 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4516    3.1993    0.8209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4437    4.1217    1.4840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1891    3.7337    2.2088 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6291    3.6796   -0.3434 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7803    1.7464    0.6249 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0028    2.3951   -0.8919 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.3780    2.1302   -0.2940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0073    0.1330   -1.1883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0147   -0.8408   -0.7439 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4063    0.8031   -0.8862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7353   -1.7871    0.2289 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0085    1.2698    0.2711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7484   -2.6687    0.5894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4398   -1.8794    0.8675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1709   -1.5963   -0.9862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9924   -2.5782   -0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3034    0.8451    0.5475 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2581   -0.4301   -1.4596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4939   -1.4689   -1.6647 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9471   -0.0210   -0.3294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3305   -1.7198    2.2489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3008   -2.1280    0.1019 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0821   -1.8088    2.8647 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9477   -2.2170    0.7176 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3320   -0.4932   -0.0615 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0570   -2.0573    2.0991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3782    3.7042    1.8389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5205    5.1401    1.1226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4268    4.4928    2.3358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2845    3.0582    3.0504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3040    4.1064   -1.0958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8932    4.4459   -0.0805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5168    1.1339    1.4921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8333    1.5920    0.3705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9392    2.4501   -1.9860 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2790    1.7153    0.7170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9228    3.0799   -0.2292 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6856    0.8834   -1.9969 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5366    1.9443    0.9758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5887   -3.4370    1.3420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7904   -3.2607    0.2471 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7948    1.1983    1.4497 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7088   -1.1058   -2.1799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2783   -1.2546   -0.9319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4839   -0.6542   -2.3963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7412   -2.3946   -2.1938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2047   -1.5181    2.8635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3602   -2.2900   -0.9710 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0035   -1.6826    3.9400 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8336   -2.4199    0.1232 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0292   -2.1271    2.5781 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 33  1  0  0  0  0
  2 33  1  0  0  0  0
  3 33  1  0  0  0  0
  4 16  2  0  0  0  0
  5 13  1  0  0  0  0
  5 14  1  0  0  0  0
  5 16  1  0  0  0  0
  6 15  1  0  0  0  0
  6 18  1  0  0  0  0
  6 46  1  0  0  0  0
  7 17  1  0  0  0  0
  7 23  2  0  0  0  0
  8 18  2  0  0  0  0
  8 26  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 12  1  0  0  0  0
  9 13  1  0  0  0  0
 10 11  1  0  0  0  0
 10 35  1  0  0  0  0
 10 36  1  0  0  0  0
 11 37  1  0  0  0  0
 11 38  1  0  0  0  0
 12 14  1  0  0  0  0
 12 39  1  0  0  0  0
 12 40  1  0  0  0  0
 13 41  1  0  0  0  0
 13 42  1  0  0  0  0
 14 15  1  0  0  0  0
 14 43  1  0  0  0  0
 15 44  1  0  0  0  0
 15 45  1  0  0  0  0
 16 17  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 25  2  0  0  0  0
 20 47  1  0  0  0  0
 21 24  2  0  0  0  0
 21 48  1  0  0  0  0
 22 29  2  0  0  0  0
 22 30  1  0  0  0  0
 23 24  1  0  0  0  0
 23 27  1  0  0  0  0
 24 49  1  0  0  0  0
 25 28  1  0  0  0  0
 25 50  1  0  0  0  0
 26 28  2  0  0  0  0
 26 51  1  0  0  0  0
 27 52  1  0  0  0  0
 27 53  1  0  0  0  0
 27 54  1  0  0  0  0
 28 33  1  0  0  0  0
 29 31  1  0  0  0  0
 29 55  1  0  0  0  0
 30 32  2  0  0  0  0
 30 56  1  0  0  0  0
 31 34  2  0  0  0  0
 31 57  1  0  0  0  0
 32 34  1  0  0  0  0
 32 58  1  0  0  0  0
 34 59  1  0  0  0  0
M  END

$$$$