B3TXZ4 -OEChem-04022112493D 33 36 0 1 0 0 0 0 0999 V2000 -0.0663 -1.4858 0.5084 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3025 -0.0267 0.6840 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7170 -0.4315 -0.3469 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9633 -2.4085 -0.0809 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6941 0.3831 0.2666 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3759 -2.0438 0.3901 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1448 -0.0476 -0.2119 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -0.5927 0.1154 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0232 1.7257 0.0259 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1408 -0.8702 -0.7382 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4901 1.1354 0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0076 -0.2156 -0.2389 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3183 2.0938 -0.3421 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3095 1.1247 -0.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4824 -0.5096 -0.6114 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8316 1.4959 0.5681 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8277 0.6735 0.0418 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6366 -1.9502 1.3038 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0416 0.4084 1.6193 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -0.3881 -1.3792 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9186 -2.3738 -1.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7375 -3.4411 0.2093 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -2.6996 -0.1146 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4695 -2.2170 1.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2626 2.4961 0.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8824 -1.7940 -1.2491 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7343 1.8028 0.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7904 -0.9629 -0.3383 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5537 3.1386 -0.5229 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3184 1.4133 -0.7515 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -1.1499 -1.0214 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1006 2.4191 1.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8721 0.9547 0.1398 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 19 1 0 0 0 0 3 7 1 0 0 0 0 3 20 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 9 25 1 0 0 0 0 10 15 1 0 0 0 0 10 26 1 0 0 0 0 11 16 2 0 0 0 0 11 27 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 17 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 M END $$$$