B3NS1V -OEChem-04022117533D 45 48 0 1 0 0 0 0 0999 V2000 1.4403 -1.9608 -1.1217 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8833 -2.8453 -0.5885 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8228 -2.1033 0.1101 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1954 -1.0791 1.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 3.0951 -0.7904 N 0 0 2 0 0 0 0 0 0 0 0 0 -0.5614 0.1618 -0.5549 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8796 2.4177 0.5138 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4646 1.0421 0.2988 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 0.8988 -1.9117 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8218 0.0430 0.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3903 2.2371 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1014 2.3507 -1.7552 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 1.0513 1.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2096 -1.1878 -0.8156 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6303 0.6551 0.8338 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7079 -1.0068 -0.1835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2639 4.4780 -0.6713 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3729 -1.5987 -0.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5294 0.9554 1.6112 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1492 -0.7086 0.6004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9688 -1.0840 0.4117 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3769 -0.1077 1.3129 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4263 -3.8076 0.3423 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7174 -1.8965 -0.9803 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5866 3.0247 1.0959 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3479 0.9162 -2.4492 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3157 0.3617 -2.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0736 2.0881 2.4184 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 3.1513 1.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1616 2.3652 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 2.8332 -2.7385 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7532 -1.8545 -1.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2262 1.3172 1.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7766 4.5575 -0.3403 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8953 5.0358 0.0288 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3473 4.9876 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8632 1.7182 2.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3562 -0.1621 1.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1437 -2.6319 -1.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7368 -3.5565 1.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -3.9177 0.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8725 -4.7721 0.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4311 -1.1022 -0.7396 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1724 -1.6435 -1.8953 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2716 -2.8239 -1.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 39 1 0 0 0 0 2 18 1 0 0 0 0 2 23 1 0 0 0 0 3 21 1 0 0 0 0 3 24 1 0 0 0 0 4 20 2 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 17 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 25 1 0 0 0 0 8 15 2 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 13 2 0 0 0 0 10 16 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 19 1 0 0 0 0 14 18 2 0 0 0 0 14 32 1 0 0 0 0 15 20 1 0 0 0 0 15 33 1 0 0 0 0 16 21 2 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 20 1 0 0 0 0 19 22 2 0 0 0 0 19 37 1 0 0 0 0 21 22 1 0 0 0 0 22 38 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END $$$$