B1BO2U -OEChem-04042105543D 44 47 0 0 0 0 0 0 0999 V2000 3.8676 0.9231 0.4834 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5289 1.2174 1.7392 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5376 1.1382 -0.7842 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3446 1.7093 0.4429 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0283 1.7188 -0.4903 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6305 0.9877 1.1538 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3451 -2.7750 -0.2898 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3756 -1.3229 1.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5872 -1.5751 0.5677 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3135 1.5261 -0.6257 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7657 1.5229 -1.1071 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2463 2.6389 -0.7703 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1446 0.5584 -0.3167 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5587 -3.0376 0.2195 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2173 -2.0568 -0.7099 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3361 -0.7718 0.5295 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8141 0.6874 0.1173 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5947 3.0794 -0.4701 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -0.6253 -0.3473 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5466 -1.5575 0.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0481 -1.3208 -1.3663 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3508 -0.0222 1.6916 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.6427 -1.3072 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2370 -1.3124 1.3955 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7954 1.3050 -1.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 1.3202 -2.1816 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4355 3.3606 -1.5704 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0666 3.1869 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3174 -0.4394 -0.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0641 0.4693 0.7571 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6196 -3.4762 -0.0948 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1991 -3.7041 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2989 -2.0610 -0.7657 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7211 -1.8447 -1.6489 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7426 -0.9241 1.4347 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7378 -0.9806 -0.3607 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9519 1.9563 1.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1335 3.7183 -1.2307 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4433 3.5384 0.5123 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6686 3.0563 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3688 -0.9322 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9949 0.2515 2.5203 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7994 -3.6369 -0.0214 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1533 -3.4973 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 4 10 1 0 0 0 0 4 37 1 0 0 0 0 5 11 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 17 2 0 0 0 0 6 22 1 0 0 0 0 7 20 1 0 0 0 0 7 23 1 0 0 0 0 7 43 1 0 0 0 0 8 20 1 0 0 0 0 8 22 2 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 44 1 0 0 0 0 M END $$$$