BNH3E5 -OEChem-04022101132D 47 49 0 1 0 0 0 0 0999 V2000 6.5385 -1.0117 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7568 -0.8249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7568 0.9771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9507 -1.8207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1263 -0.2027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 0.7572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2430 2.7462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7295 -0.4239 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4340 2.1584 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1906 0.0761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7784 0.8851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7295 0.5761 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7784 -0.7329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5385 1.1639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7818 -1.0474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7818 1.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3475 -1.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2430 -2.5940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2611 -1.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 -3.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0701 -1.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9656 -2.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7746 -3.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0306 1.4515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2415 1.1951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2819 0.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2415 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0306 -1.2993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2971 -1.4339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0508 -1.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0508 1.7582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2971 1.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3955 -0.2859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -0.9825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 1.1347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3955 0.4382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8676 2.4106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6766 -2.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3259 -0.5761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9872 -3.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6365 -1.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1782 3.3628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4101 -3.8644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2762 -3.7272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 -2.8612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 19 1 0 0 0 0 2 10 1 0 0 0 0 2 15 1 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 6 14 2 0 0 0 0 7 9 1 0 0 0 0 7 44 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 14 1 1 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$