B9OE8I -OEChem-04022117413D 54 57 0 0 0 0 0 0 0999 V2000 4.4956 -0.1835 -0.0731 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 2.4910 0.2721 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 2.8566 -0.5057 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6083 2.1155 1.4948 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0481 1.4859 -0.6058 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6105 -0.7062 -1.2727 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8597 -1.5253 -0.9943 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6971 1.9552 0.2539 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1904 -2.8829 -1.9299 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5138 -3.4189 0.6543 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3477 1.4634 -0.4063 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1093 1.4206 -0.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0099 0.4650 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 0.4112 0.2956 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1402 2.4941 -0.9118 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3168 0.3898 0.4919 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5209 2.4725 -0.7154 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5883 1.3978 0.1981 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2989 0.7131 -0.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3401 0.1587 0.3158 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1902 -0.3290 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3501 -1.3041 -0.2674 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7199 -0.9706 0.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3387 -0.7600 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0634 -0.1110 1.4776 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5723 -1.6435 -1.3715 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 -2.2177 0.5398 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0606 -1.9481 -0.6219 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7855 -1.2992 1.5896 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6628 -0.3928 -0.6037 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0501 -1.2379 1.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9358 -0.0824 -0.1253 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 -0.9274 2.0535 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2659 -0.3498 1.2031 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4004 2.4027 -0.8684 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.3949 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6945 3.3187 -1.4623 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7471 -0.4337 1.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1221 3.2817 -1.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4117 -1.5586 -1.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9655 -2.1810 0.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7839 -0.5617 -1.6476 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0709 0.5961 2.3031 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4168 -0.1775 -1.6401 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3235 -1.6855 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0523 -2.6556 -1.4472 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3448 -1.4980 2.5002 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6698 0.3679 -0.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5799 -1.1349 3.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2570 -0.1079 1.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8773 -3.6181 -2.0245 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2344 -3.0202 -2.2278 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0391 -3.6140 1.4962 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5143 -4.0853 -0.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 18 2 0 0 0 0 3 8 1 0 0 0 0 4 8 2 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 35 1 0 0 0 0 6 13 1 0 0 0 0 6 26 2 0 0 0 0 7 21 2 0 0 0 0 7 26 1 0 0 0 0 8 19 1 0 0 0 0 9 26 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 10 27 1 0 0 0 0 10 53 1 0 0 0 0 10 54 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 13 19 2 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 17 2 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 30 2 0 0 0 0 23 31 1 0 0 0 0 24 28 1 0 0 0 0 24 42 1 0 0 0 0 25 29 2 0 0 0 0 25 43 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 30 32 1 0 0 0 0 30 44 1 0 0 0 0 31 33 2 0 0 0 0 31 45 1 0 0 0 0 32 34 2 0 0 0 0 32 48 1 0 0 0 0 33 34 1 0 0 0 0 33 49 1 0 0 0 0 34 50 1 0 0 0 0 M CHG 2 3 -1 8 1 M END $$$$