B4KT2S -OEChem-04042103363D 29 31 0 0 0 0 0 0 0999 V2000 3.4215 2.7963 -0.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2987 -2.2336 0.1938 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2714 1.2367 -0.2196 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4491 0.1533 -0.1124 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1855 0.0975 0.0156 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3703 -1.1162 0.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 0.0564 -0.0604 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7533 -0.9865 0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 0.0633 -0.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0889 -2.4946 0.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2951 -3.1589 0.3258 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5191 -0.6643 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4894 0.7995 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6232 1.2122 -0.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9138 -0.6556 -0.9809 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8841 0.8082 0.9409 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5964 0.0806 -0.0124 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2199 3.9160 0.3227 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0251 0.0899 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1172 -2.9629 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2879 -2.4397 0.2063 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5279 -4.2062 0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -1.2373 -1.7662 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9508 1.3711 1.6783 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4552 -1.2260 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4019 1.3867 1.7023 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 4.9261 0.3453 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0085 3.6045 1.3493 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2903 3.9410 -0.2523 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 2 21 1 0 0 0 0 3 7 1 0 0 0 0 3 14 2 0 0 0 0 4 8 2 0 0 0 0 4 14 1 0 0 0 0 5 19 3 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 22 1 0 0 0 0 12 15 1 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 24 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 19 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 M END $$$$