BS9E0W -OEChem-04022103493D 48 51 0 0 0 0 0 0 0999 V2000 -4.2147 -2.6206 -1.3024 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6638 -1.9608 2.2886 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0886 1.2194 2.0927 O 0 5 0 0 0 0 0 0 0 0 0 0 5.7106 -0.8752 1.8816 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4497 -0.6232 -1.2813 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7907 -1.2112 1.0261 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3093 0.7406 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6968 -0.8758 0.5117 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4366 0.2434 1.3889 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5003 0.5615 -0.5818 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5005 0.5072 0.3917 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8491 -0.7501 0.2515 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4548 -1.4222 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3461 1.6658 -0.7348 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 1.6077 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3222 -0.9740 -2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1632 2.7455 0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1739 2.7192 1.1145 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1591 -0.2589 -0.3234 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4306 0.1710 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7202 -0.9477 0.6883 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1089 0.3691 0.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8665 -1.6051 -0.1753 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6217 -1.9476 0.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5238 0.4116 -0.0228 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6138 -1.3134 1.2458 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5516 0.3457 -2.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1842 1.4874 0.8586 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7381 0.8272 -0.5693 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7658 0.7614 -2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8592 1.0021 -1.9479 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1185 1.6932 -1.4961 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5674 1.6023 2.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1865 -0.2339 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0787 -1.9675 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3532 -0.9646 -2.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8036 3.6191 0.0415 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0506 3.5710 1.7781 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5751 -2.3804 -0.4488 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3654 -2.9961 0.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4737 -3.0036 -0.8007 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 0.1637 -2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7161 2.4453 0.8425 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6358 1.5567 0.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2206 1.3627 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5995 1.0188 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8601 0.8978 -3.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8045 1.3257 -2.3735 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 41 1 0 0 0 0 2 26 2 0 0 0 0 3 9 1 0 0 0 0 4 9 2 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 8 2 0 0 0 0 6 12 1 0 0 0 0 7 19 2 0 0 0 0 7 22 1 0 0 0 0 8 26 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 25 1 0 0 0 0 20 27 2 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 21 26 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 29 2 0 0 0 0 27 30 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 31 1 0 0 0 0 29 46 1 0 0 0 0 30 31 2 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 M CHG 2 3 -1 9 1 M END $$$$