B9CE6S -OEChem-04022111593D 63 66 0 1 0 0 0 0 0999 V2000 -3.9331 0.9808 -0.9740 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0924 -0.5215 0.4017 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9914 1.2345 1.4587 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6549 0.9990 -2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9005 -0.0040 -0.7159 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2058 -0.7941 -1.3252 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6855 -0.1241 2.0494 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2423 -1.9444 -2.0259 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1155 2.0369 0.8032 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3257 2.5378 -0.6367 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6109 -0.8917 0.7639 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7241 -0.0301 1.4189 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1888 -2.1793 0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 0.4221 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4266 -1.8766 -0.6437 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5321 -1.2475 1.7846 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1396 -0.7120 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1548 -2.6009 -1.6044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5216 0.1554 1.3327 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8031 1.3740 1.8714 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8278 2.8255 -0.1357 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2966 1.8976 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9348 2.6146 -0.4434 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1954 3.4538 -1.1434 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2297 3.3479 -1.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1389 0.8451 0.3223 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3187 2.9493 0.0159 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7996 -0.4926 0.1922 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1125 -1.6488 0.5624 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1016 -0.5824 -0.3002 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0296 -2.9845 -0.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7275 -2.8948 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7165 -1.8284 -0.4225 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6872 -4.3166 -0.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1614 -0.2926 -0.0418 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2084 -0.6148 2.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2961 0.8589 1.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4388 -2.6310 -0.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4269 -2.9144 0.8958 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6786 0.7916 0.9352 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3986 1.2461 -0.2009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9698 -1.5733 2.7342 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9063 -2.0646 1.4078 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9443 -3.5776 -2.0158 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9401 -0.1137 -1.4774 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 0.4934 2.8098 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4828 2.0674 2.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0968 1.0197 2.6307 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7329 4.0585 -1.8663 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7183 3.2831 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6836 3.8754 -2.1376 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6422 0.9390 1.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8548 1.6653 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5876 3.3723 0.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7436 3.6201 -0.7404 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8163 1.9846 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1064 -1.5978 0.9689 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 0.3100 -0.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1844 -3.7877 0.7378 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7318 -1.8853 -0.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2204 -4.5642 0.7405 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4010 -4.3254 -1.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9514 -5.1024 -0.3849 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 10 1 0 0 0 0 1 26 1 0 0 0 0 2 19 2 0 0 0 0 3 22 2 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 45 1 0 0 0 0 7 16 1 0 0 0 0 7 19 1 0 0 0 0 7 46 1 0 0 0 0 8 18 2 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 35 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 15 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 17 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 24 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 51 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 32 1 0 0 0 0 29 57 1 0 0 0 0 30 33 2 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 M END $$$$