B25XCI -OEChem-04042102103D 35 37 0 0 0 0 0 0 0999 V2000 0.4558 1.1807 0.0396 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0262 2.3540 0.2817 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9154 0.1058 -0.2165 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3363 0.7648 0.0933 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2271 1.5404 0.1387 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5452 -0.6110 -0.0784 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7395 -1.5463 -0.1126 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9265 -0.5447 -0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1925 0.6511 0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2856 -0.4159 -0.1293 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7829 -0.2774 -0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6314 1.2019 0.1649 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -1.2094 -0.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5711 0.0457 0.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5309 -0.6018 0.9788 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4238 0.1757 -1.3062 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5604 -0.0205 -0.1957 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9197 -0.4735 0.9574 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8125 0.3041 -1.3276 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0233 -2.3801 -0.1332 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6181 -0.2436 0.9753 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2302 2.5461 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9633 -0.9070 -1.0554 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -1.0702 0.6985 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6326 0.2600 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0439 -0.9541 1.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8532 0.4293 -2.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4388 -0.7422 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3062 0.6571 -2.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8786 -2.9137 -1.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0741 -2.0766 -0.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8338 -3.0772 0.6899 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3439 0.4100 1.8103 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4937 -1.3040 1.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6837 -0.0835 0.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 12 2 0 0 0 0 3 17 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 14 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 25 1 0 0 0 0 15 18 1 0 0 0 0 15 26 1 0 0 0 0 16 19 2 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END $$$$