BK9IR7 -OEChem-04022106263D 37 39 0 0 0 0 0 0 0999 V2000 0.1100 -1.1302 1.3730 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0875 1.4438 1.9422 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2628 1.6497 -1.1808 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 0.3843 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0648 -0.3748 -0.3305 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6582 -1.8525 0.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8125 -1.2444 -1.2084 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0609 -0.4566 0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3307 -1.5857 -1.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 0.7680 0.1653 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4649 -0.3337 -1.2579 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7944 0.7780 0.9477 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4141 0.3644 0.7237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5904 1.0137 0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8047 0.2702 0.0528 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6858 -0.9211 0.7446 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4133 2.3299 -0.6232 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0841 0.6110 -0.5513 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7948 -1.5376 0.3947 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3992 -0.1764 -0.8739 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4075 -2.1643 -1.2021 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1448 -0.6513 -2.0693 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1106 -0.1472 0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8728 -1.1100 0.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0401 -2.2999 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1627 -2.0728 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3968 1.4859 -0.6268 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3071 1.2727 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4127 -0.6111 -1.3405 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6814 0.3555 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6016 2.2442 -1.6986 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5982 2.7296 -0.5002 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1076 3.0665 -0.2055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6534 -2.2204 0.4887 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3227 -0.0706 -1.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0651 -1.0083 -0.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8084 0.7538 -0.4677 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 12 2 0 0 0 0 3 18 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 16 1 0 0 0 0 6 19 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 M END $$$$