BA5C8B -OEChem-04022112523D 43 42 0 1 0 0 0 0 0999 V2000 -3.0984 0.1796 0.2077 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2086 -2.8981 0.4406 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3918 -1.6487 1.9116 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7451 0.9083 -0.6889 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 1.2855 0.9271 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1046 -1.4438 0.1495 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5095 -1.5295 -2.4877 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5138 -1.5061 -1.4150 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0644 -2.4438 -0.2714 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7801 -0.0381 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1032 -1.8014 0.7262 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1851 -0.8376 0.8925 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0172 1.9783 0.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4271 -1.7128 0.8282 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8646 2.3860 1.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4992 0.5647 0.3927 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7814 3.8996 1.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9737 2.2193 -1.2162 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0623 2.4385 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4414 -1.9108 -1.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5842 -3.3446 -0.6722 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0823 0.5187 -1.9212 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8644 0.4246 -0.6532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8725 -0.7281 1.9372 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2355 -1.5826 -0.8485 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8387 -0.9777 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -2.4826 -2.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9649 2.3199 0.7894 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9276 2.4364 -0.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7828 -1.8190 -0.2031 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2445 -1.2836 1.4173 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 -2.7164 1.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9964 1.9518 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9047 2.0270 0.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6863 -2.1178 0.7696 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6098 4.3700 0.4309 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7052 4.3079 1.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9543 4.1764 2.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7605 2.9665 -0.4436 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0194 2.3078 -1.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2302 1.6710 -3.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0123 2.3643 -2.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2304 3.4233 -2.8497 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 2 9 1 0 0 0 0 2 35 1 0 0 0 0 3 11 2 0 0 0 0 4 16 1 0 0 0 0 4 18 1 0 0 0 0 5 16 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 24 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 17 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 M END $$$$