B3V9GD -OEChem-04012115043D 40 42 0 0 0 0 0 0 0999 V2000 -2.2945 0.0493 -2.3424 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8605 0.8433 0.2026 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3087 1.4788 -0.1475 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4512 -1.1765 -0.8601 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0646 1.5362 0.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5777 0.2761 -0.7704 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6389 0.3763 -0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1965 2.5115 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6026 -0.4174 -0.9263 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5799 2.6982 0.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8613 -0.1987 -1.1956 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6849 3.6025 0.8227 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7411 3.6886 1.0808 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6698 2.4199 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0377 0.0588 -0.3251 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7689 -1.0153 -0.3145 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0063 -1.4445 -0.7945 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3714 -1.3440 0.9814 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8173 -1.6486 -0.8552 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8462 -2.2025 0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2111 -2.1018 1.7975 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4486 -2.5311 1.3175 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1057 -2.4149 0.3567 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3465 -3.0442 1.3504 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6838 -1.3933 -1.3858 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 2.8002 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3026 4.4379 1.1335 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1122 4.5831 1.5695 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8744 2.2976 -1.1179 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1878 3.3373 0.2542 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1266 1.6087 0.5202 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7608 -1.8004 -1.2642 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3415 -1.2031 -1.7994 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4164 -1.0259 1.3886 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9484 -2.2714 -1.7456 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4928 -0.7911 -0.9373 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8098 -2.5368 -0.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9022 -2.3575 2.8068 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1026 -3.1210 1.9531 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5598 -3.6023 2.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 15 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 4 15 1 0 0 0 0 4 19 1 0 0 0 0 4 32 1 0 0 0 0 5 7 2 0 0 0 0 5 10 1 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 8 12 2 0 0 0 0 8 14 1 0 0 0 0 9 25 1 0 0 0 0 10 13 2 0 0 0 0 10 26 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 21 2 0 0 0 0 18 34 1 0 0 0 0 19 23 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 3 0 0 0 0 24 40 1 0 0 0 0 M END $$$$