423
 OpenBabel09292113373D

 55 58  0  0  1  0  0  0  0  0999 V2000
    1.1422   -0.2400   -0.2673 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4964   -0.2182   -0.1536 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1651   -1.3355   -0.1286 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5104   -1.1718   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1974    0.0221    0.0546 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5887   -0.2560    0.0880 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7232    0.7140    0.0797 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7328    1.5721    1.2646 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8399    0.8331    2.5233 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.0809    0.0063    2.6784 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6161    0.1150    3.9040 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8183    1.0407    4.7565 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.9606    0.2855    5.6179 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9647    1.8139    3.7251 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.6874    2.1673    4.2757 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6937   -1.6379    0.1228 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4352   -2.1886    0.0210 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1417   -3.6072   -0.1144 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6401   -4.3355    1.0279 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2095   -5.5935    0.5643 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.7325   -5.6462    0.7179 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1210   -5.6465    2.0974 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8263   -5.7415    2.3731 P   0  0  0  0  0  0  0  0  0  0  0  0
    9.7471   -7.1371    1.7125 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9347   -4.4330    1.5561 O   0  5  0  0  0  0  0  0  0  0  0  0
   11.5315   -5.8365    2.6488 O   0  5  0  0  0  0  0  0  0  0  0  0
    5.7989   -5.7075   -0.9118 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4585   -6.2466   -1.0683 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7375   -4.2552   -1.3647 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9087   -4.1174   -2.5283 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4319    1.2419    0.0637 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9010    2.3707    0.1803 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0734    1.0263   -0.0596 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7812   -1.1717   -0.0844 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6406    0.4831    0.2274 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6305    1.3526   -0.8071 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6811    0.1943   -0.0358 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8593    2.1047    1.2782 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9509    0.2069    2.6706 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4457   -0.6993    1.9416 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4593   -0.4606    4.2457 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4321    1.7153    5.3575 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8897   -0.6093    5.2275 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4818    2.7361    3.4273 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5207    1.4739    4.9475 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5704   -2.2775    0.1962 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0508   -3.7174   -0.1105 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7544   -6.3824    1.1730 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1781   -4.7999    0.1907 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0773   -6.5728    0.2463 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4609   -6.3217   -1.5289 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0877   -6.3470   -0.1720 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7364   -3.8724   -1.5983 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2582   -4.8453   -2.4517 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5086    1.8546   -0.0976 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 34  1  0  0  0  0
  1 35  1  0  0  0  0
  2  3  2  0  0  0  0
  2 33  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  5 31  1  0  0  0  0
  6  7  1  0  0  0  0
  6 16  2  0  0  0  0
  7  8  1  0  0  0  0
  7 36  1  0  0  0  0
  7 37  1  0  0  0  0
  8  9  1  0  0  0  0
  8 38  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
  9 39  1  1  0  0  0
 10 11  2  0  0  0  0
 10 40  1  0  0  0  0
 11 12  1  0  0  0  0
 11 41  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 42  1  1  0  0  0
 13 43  1  0  0  0  0
 14 15  1  0  0  0  0
 14 44  1  6  0  0  0
 15 45  1  0  0  0  0
 16 17  1  0  0  0  0
 16 46  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 29  1  0  0  0  0
 18 47  1  6  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 27  1  0  0  0  0
 20 48  1  1  0  0  0
 21 22  1  0  0  0  0
 21 49  1  0  0  0  0
 21 50  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 23 26  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 51  1  6  0  0  0
 28 52  1  0  0  0  0
 29 30  1  0  0  0  0
 29 53  1  6  0  0  0
 30 54  1  0  0  0  0
 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
 33 55  1  0  0  0  0
M  CHG  2  25  -1  26  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
