BX3E9S -OEChem-04022100302D 36 40 0 0 0 0 0 0 0999 V2000 11.4550 0.4166 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8907 -1.7856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8848 -1.7847 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 0.8122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6085 1.7911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7406 2.2878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0810 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3901 -0.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 -0.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0811 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5811 -0.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1928 -0.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7566 -0.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0537 0.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 1.4826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3756 1.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0764 0.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1444 -0.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9524 -1.1214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4550 0.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7624 -0.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4102 0.7038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6875 0.8268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0162 1.3145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5719 -1.0772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5945 2.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5271 -2.2878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9625 1.7363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5518 -0.2590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3108 -0.5023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9513 -1.7414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0915 0.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3517 -0.7276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1023 0.1657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3931 1.7424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 28 1 0 0 0 0 3 12 2 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 10 15 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 M END $$$$