B5PH2K -OEChem-04042102253D 34 36 0 0 0 0 0 0 0999 V2000 1.7122 2.6575 0.0358 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2093 -0.4189 -0.0486 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8413 -2.0126 0.0229 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5387 1.1686 -0.0051 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0174 0.5715 0.0182 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4916 -1.7498 0.0134 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0919 -1.2113 -0.0106 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2915 0.3590 0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8097 -1.0319 0.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8483 -0.5000 0.0128 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2628 -0.1489 0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1994 1.5380 0.0175 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0004 -0.1716 -0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2277 -1.1538 -0.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6454 1.1909 0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1825 -3.4262 0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9672 0.5229 -0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5438 2.2245 -0.0133 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5813 -0.8176 -0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9991 1.5272 -0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4148 0.8823 -0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9612 -2.2072 -0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9256 2.0045 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -3.6882 -0.9303 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2942 -4.0594 0.1151 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8581 -3.6633 0.8397 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0935 3.2199 0.0056 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1569 2.1201 -0.9141 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1915 2.1017 0.8605 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3264 -1.6088 -0.0183 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2877 2.5751 -0.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7871 0.9697 1.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5823 1.8336 -0.5404 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0063 0.1246 -0.5488 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 13 2 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 3 16 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 18 1 0 0 0 0 5 8 2 0 0 0 0 5 10 1 0 0 0 0 6 10 2 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 14 19 1 0 0 0 0 14 22 1 0 0 0 0 15 20 2 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 M END $$$$