BMP3N9 -OEChem-04022104233D 57 61 0 1 0 0 0 0 0999 V2000 -0.5985 5.7774 -1.5263 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.6575 -0.6389 0.2738 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3788 -4.2911 -0.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0325 -1.4618 0.0978 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9576 -0.6546 0.0843 N 0 0 1 0 0 0 0 0 0 0 0 0 0.2471 -2.2727 -0.7997 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7693 -1.7460 -1.3225 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5945 -0.0714 -0.0428 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2350 -0.8394 -1.0954 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8917 -2.1023 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0822 -2.8568 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7389 0.0012 1.1407 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5957 1.4055 -0.4172 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3799 -3.0780 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2202 -0.1589 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5923 1.9133 -1.2506 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4003 2.2499 0.0735 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6969 -2.4372 -0.7917 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8908 -1.2538 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9219 0.7880 0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 3.2653 -1.5932 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3997 3.6020 -0.2691 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 4.1097 -1.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 -1.4018 1.2679 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2943 0.6400 -0.0233 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7534 -2.6064 -1.6516 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9648 -0.4551 0.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -1.0987 -0.2859 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8918 -0.0615 0.5031 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1764 0.3877 0.1976 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1943 0.4962 1.5745 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7637 1.3947 0.9636 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7814 1.5031 2.3405 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0662 1.9525 2.0351 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0947 -0.1789 0.9317 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2078 -0.7285 -2.0948 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2439 -0.4280 -1.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8885 -2.5507 0.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4469 -2.2806 1.3583 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5634 -2.7926 -1.6655 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0189 -3.9166 -0.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 1.0793 1.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4593 -0.3676 2.1379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3627 1.2735 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1831 1.8659 0.7219 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3643 -1.9907 2.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4178 1.6505 -0.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3724 3.6458 -2.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1824 4.2480 0.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7732 -2.2579 1.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8285 1.3864 -0.6056 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8385 -3.2926 -2.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7392 -0.0319 -0.6328 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1914 0.1743 1.8438 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 1.7448 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2384 1.9382 3.1745 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5233 2.7367 2.6315 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 27 1 0 0 0 0 3 14 2 0 0 0 0 4 18 1 0 0 0 0 4 28 1 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 7 26 1 0 0 0 0 7 28 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 15 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 16 44 1 0 0 0 0 17 22 2 0 0 0 0 17 45 1 0 0 0 0 18 26 2 0 0 0 0 19 24 1 0 0 0 0 19 46 1 0 0 0 0 20 25 2 0 0 0 0 20 47 1 0 0 0 0 21 23 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 24 27 2 0 0 0 0 24 50 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 32 1 0 0 0 0 30 53 1 0 0 0 0 31 33 2 0 0 0 0 31 54 1 0 0 0 0 32 34 2 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 34 57 1 0 0 0 0 M END $$$$