BB3CH2 -OEChem-04022106453D 47 50 0 0 0 0 0 0 0999 V2000 1.2556 -2.2259 -0.9247 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5616 -3.3154 1.6561 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2926 -0.5582 -0.2149 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1013 -0.0420 0.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -1.5291 0.6764 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 -1.5336 -2.2152 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6246 -0.7282 -2.0043 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0187 -0.9680 1.2621 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9498 0.0536 -0.7718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -2.0712 0.9844 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6499 -0.2430 -0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2596 0.6961 -0.1027 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5389 -2.2362 1.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1055 1.0914 0.9601 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 1.0820 -1.4101 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7863 -1.6110 0.6986 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2653 1.8313 0.7285 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7976 1.8219 -1.6418 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6111 2.1965 -0.5724 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7982 -1.3888 -1.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4486 -0.1788 -0.8253 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2708 0.7418 -0.0955 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8728 1.1987 1.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4787 1.1924 -0.6391 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6727 2.0951 1.8745 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2787 2.0887 0.0697 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8756 2.5400 1.3265 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9896 -1.4425 1.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -0.4124 2.1626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 1.0599 -1.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0776 -0.6573 -1.5974 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9382 -2.7498 1.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3079 -2.6679 0.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8232 -0.2040 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4705 0.5252 0.7385 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8606 0.8356 1.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0359 0.7959 -2.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5232 -1.9365 1.4419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7553 -0.5197 0.7412 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8975 2.1255 1.5611 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0690 2.1039 -2.6549 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5140 2.7726 -0.7529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9423 0.8751 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8137 0.8548 -1.6172 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3592 2.4469 2.8531 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2155 2.4354 -0.3568 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4985 3.2379 1.8783 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 20 1 0 0 0 0 2 13 2 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 20 2 0 0 0 0 7 21 2 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 14 36 1 0 0 0 0 15 18 2 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 19 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 24 26 2 0 0 0 0 24 44 1 0 0 0 0 25 27 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 M END $$$$