B43TGE -OEChem-04042105033D 52 56 0 0 0 0 0 0 0999 V2000 7.0798 -2.2962 1.3398 O 0 5 0 0 0 0 0 0 0 0 0 0 7.9301 -1.4932 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2563 1.2254 -0.1943 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5059 1.7140 -0.3156 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2743 0.1064 0.1137 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0153 -1.5413 0.3395 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9241 -3.0034 -0.7766 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5222 1.3321 1.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 0.8547 -1.4054 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7605 2.2109 0.8442 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7298 1.7427 -1.5557 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6088 0.8782 -0.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6253 0.9052 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6105 1.8485 0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9416 -0.4683 -0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9483 1.4124 0.1479 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6544 0.9419 -1.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7194 0.0576 0.9504 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2776 -0.7982 -0.0204 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3064 3.2199 0.0877 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9431 2.3767 0.2848 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7778 0.1314 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8425 -0.7529 1.1137 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8719 -0.7161 0.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3211 4.1627 0.2252 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7079 -2.1760 -0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6409 3.7402 0.3239 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8452 -2.5825 0.6295 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2009 -3.9248 0.5578 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3013 -4.3008 -0.8233 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4194 -4.8069 -0.1804 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 0.3247 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0869 1.7794 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1371 0.9716 -2.2954 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7945 -0.1983 -1.3425 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4415 3.2410 0.6384 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3718 2.2604 1.7528 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 1.4167 -2.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4193 2.7759 -1.7567 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1691 -1.2261 -0.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6073 1.6054 -1.9539 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9439 -0.0078 1.7055 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 3.5812 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9849 2.0714 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5616 0.1886 -1.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8818 -1.4014 1.9853 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0826 5.2215 0.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4391 4.4689 0.4313 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4547 -1.9021 1.2153 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 -4.2836 1.0778 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6587 -4.9473 -1.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6772 -5.8574 -0.2498 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 2 6 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 16 1 0 0 0 0 5 19 2 0 0 0 0 6 24 1 0 0 0 0 7 26 1 0 0 0 0 7 30 2 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 20 2 0 0 0 0 15 19 1 0 0 0 0 15 40 1 0 0 0 0 16 21 2 0 0 0 0 17 22 1 0 0 0 0 17 41 1 0 0 0 0 18 23 2 0 0 0 0 18 42 1 0 0 0 0 19 26 1 0 0 0 0 20 25 1 0 0 0 0 20 43 1 0 0 0 0 21 27 1 0 0 0 0 21 44 1 0 0 0 0 22 24 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 25 27 2 0 0 0 0 25 47 1 0 0 0 0 26 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 31 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M CHG 2 1 -1 6 1 M END $$$$