B4N1UE
  -OEChem-04022110543D

 42 44  0     0  0  0  0  0  0999 V2000
   -4.9579    0.8903   -0.0307 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.8390   -5.6668    0.4571 F   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4001    2.0862    0.6735 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4603    0.6121   -1.3687 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9655    1.6366   -0.4322 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6801    2.0286   -0.4237 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0141    0.8809   -0.2710 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8676   -0.2352   -0.1828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4259    0.8834   -0.2133 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1321    0.2902   -0.2911 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6022   -1.6367   -0.0178 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2133    0.8877   -0.1006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1633    0.1703   -1.1587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0823    1.5985    0.7884 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0122    2.6196   -0.5793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5570    0.1724   -1.1023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4760    1.6007    0.8448 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0249   -2.5456   -0.9878 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9218   -2.0892    1.1127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3613   -0.4986    1.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7672   -3.9071   -0.8274 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6641   -3.4506    1.2731 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2955    3.3512    0.6996 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0868   -4.3596    0.3032 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2240    4.6806    0.8306 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1136   -0.1654   -0.2775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6709   -0.3898   -1.9502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5244    2.1559    1.5373 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7130    3.2984   -1.3865 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9188    2.0996   -0.9092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1106   -0.3947   -1.8452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9667    2.1583    1.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5525   -2.2129   -1.8786 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5881   -1.3972    1.8822 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4489   -0.5563    1.0856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9739   -1.4092    0.5436 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9217   -0.3456    1.9919 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0950   -4.6150   -1.5829 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1351   -3.8034    2.1535 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5916    2.7593    1.5622 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4489    5.1519    1.7811 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9416    5.3177   -0.0001 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1 12  1  0  0  0  0
  1 20  1  0  0  0  0
  2 24  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  2  0  0  0  0
  8 11  1  0  0  0  0
  9 13  2  0  0  0  0
  9 14  1  0  0  0  0
 10 26  1  0  0  0  0
 11 18  2  0  0  0  0
 11 19  1  0  0  0  0
 12 16  2  0  0  0  0
 12 17  1  0  0  0  0
 13 16  1  0  0  0  0
 13 27  1  0  0  0  0
 14 17  2  0  0  0  0
 14 28  1  0  0  0  0
 15 23  1  0  0  0  0
 15 29  1  0  0  0  0
 15 30  1  0  0  0  0
 16 31  1  0  0  0  0
 17 32  1  0  0  0  0
 18 21  1  0  0  0  0
 18 33  1  0  0  0  0
 19 22  2  0  0  0  0
 19 34  1  0  0  0  0
 20 35  1  0  0  0  0
 20 36  1  0  0  0  0
 20 37  1  0  0  0  0
 21 24  2  0  0  0  0
 21 38  1  0  0  0  0
 22 24  1  0  0  0  0
 22 39  1  0  0  0  0
 23 25  2  0  0  0  0
 23 40  1  0  0  0  0
 25 41  1  0  0  0  0
 25 42  1  0  0  0  0
M  END

$$$$