B41NTR
  -OEChem-04022102383D

 46 47  0     0  0  0  0  0  0999 V2000
   -6.6697    3.5059    0.5242 I   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0084   -1.4612   -0.4177 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8160   -2.6808   -1.3941 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9643   -0.2782    0.2073 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2002    2.3168   -0.1039 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2910   -2.5573    0.6484 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7800    0.3107    1.2763 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3305    0.7766   -0.5934 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8330    1.2620    0.6974 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3827    1.7290   -1.1721 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9598   -1.1845    0.7600 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5465   -2.2187   -0.2884 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2056    3.2217   -0.6578 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5096   -3.2034    0.2444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7801   -2.3479   -0.2127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9320   -1.6479    0.4764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8144   -0.3668   -0.2097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9974    0.1300    1.0809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4497    0.2462   -1.2896 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8159    1.2396    1.2915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2682    1.3559   -1.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4513    1.8525    0.2115 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3035   -0.4812    1.8258 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1498    0.8488    1.9975 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7757    0.3472   -1.4345 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6131    1.3500    0.0096 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3867    1.7115    1.5306 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5540    0.6922    0.0955 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0107    1.1898   -1.8945 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8635    2.5242   -1.7208 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0967   -0.6329    1.1528 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3827   -1.7413    1.6071 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4284   -2.7820   -0.6183 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1320   -1.7265   -1.1756 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7830    3.6925    0.1456 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7261    4.0328   -1.2170 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9034    2.7065   -1.3278 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9016   -3.7361    1.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2809   -3.9477   -0.5264 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2193   -2.2402    1.6109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2603   -2.2658    1.3200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5320   -0.6935    0.8442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5417   -0.3348    1.9501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3103   -0.1366   -2.2969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9497    1.6075    2.3057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7537    1.8184   -1.9347 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 22  1  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  3 15  2  0  0  0  0
  4  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4 11  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 13  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  0  0  0  0
  6 40  1  0  0  0  0
  7  9  1  0  0  0  0
  7 23  1  0  0  0  0
  7 24  1  0  0  0  0
  8 10  1  0  0  0  0
  8 25  1  0  0  0  0
  8 26  1  0  0  0  0
  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
 10 29  1  0  0  0  0
 10 30  1  0  0  0  0
 11 12  1  0  0  0  0
 11 31  1  0  0  0  0
 11 32  1  0  0  0  0
 12 14  1  0  0  0  0
 12 33  1  0  0  0  0
 12 34  1  0  0  0  0
 13 35  1  0  0  0  0
 13 36  1  0  0  0  0
 13 37  1  0  0  0  0
 14 38  1  0  0  0  0
 14 39  1  0  0  0  0
 15 16  1  0  0  0  0
 16 41  1  0  0  0  0
 16 42  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 43  1  0  0  0  0
 19 21  2  0  0  0  0
 19 44  1  0  0  0  0
 20 22  2  0  0  0  0
 20 45  1  0  0  0  0
 21 22  1  0  0  0  0
 21 46  1  0  0  0  0
M  END

$$$$