B3GOP9 -OEChem-04012113063D 40 42 0 0 0 0 0 0 0999 V2000 0.0429 -3.3180 -0.5080 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1389 -0.3594 0.0883 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0767 0.3991 0.5126 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -1.0656 0.3671 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7727 2.0105 -0.2748 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2837 1.2474 0.9581 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 3.1922 0.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3805 0.1007 0.5821 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2438 -0.6065 0.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7672 -1.8700 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1435 -2.0689 0.0317 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7189 0.9260 0.3361 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1142 3.9790 -1.0981 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 0.8822 0.1257 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5094 -3.4181 -0.2549 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4196 -4.2003 -0.5625 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0408 0.5684 1.1913 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7301 1.1563 -1.1314 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4214 0.5279 0.9962 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1107 1.1157 -1.3263 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9564 0.8014 -0.2626 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3308 1.3343 -0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9117 2.3732 -0.8508 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 0.8623 1.5254 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7417 1.9250 1.6295 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5368 2.8319 0.6674 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1084 3.8613 0.7928 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5034 1.2539 1.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2799 1.6818 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7307 -1.1444 -0.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6934 3.3468 -1.7787 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2578 4.3821 -1.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7469 4.8180 -0.7924 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5233 -3.7972 -0.2365 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4142 -5.2507 -0.8171 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6346 0.3517 2.1754 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0804 1.4002 -1.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0799 0.2826 1.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5273 1.3281 -2.3066 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0313 0.7695 -0.4144 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 16 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 2 30 1 0 0 0 0 3 8 1 0 0 0 0 3 9 2 0 0 0 0 4 8 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 13 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 15 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 18 20 2 0 0 0 0 18 37 1 0 0 0 0 19 21 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 M END $$$$