D00TNC -OEChem-04152110343D 28 31 0 0 0 0 0 0 0999 V2000 3.6666 2.0482 0.3302 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1817 -0.0923 -0.0149 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1143 -1.4512 0.0089 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5371 -1.9464 0.0177 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6308 0.7174 0.0023 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9773 -0.7855 -0.0078 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 0.4102 0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8284 -0.6187 0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2908 -0.2563 0.0597 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5347 -0.0170 0.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2934 1.8533 -0.0211 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2535 -1.3786 0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5235 1.1748 -0.4059 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5976 -0.1726 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2437 -2.3444 0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0340 0.1607 -0.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5781 1.4567 -0.0159 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9309 1.2419 -0.0196 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6158 -0.3595 1.1021 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8764 -0.9502 -0.5526 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1266 2.2574 -1.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6914 2.4366 0.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5593 1.4689 -0.2091 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3406 1.2930 -1.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -2.2998 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0481 -3.4081 0.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0717 2.4108 -0.0177 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7980 1.8853 -0.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 2 6 1 0 0 0 0 2 18 1 0 0 0 0 3 12 1 0 0 0 0 3 14 1 0 0 0 0 3 25 1 0 0 0 0 4 8 2 0 0 0 0 4 15 1 0 0 0 0 5 10 1 0 0 0 0 5 14 2 0 0 0 0 6 16 2 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 13 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 15 2 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 14 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 M END $$$$