BA31HP -OEChem-04022114343D 50 53 0 0 0 0 0 0 0999 V2000 1.2130 0.4230 2.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4044 -1.8084 1.0753 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 0.9744 -1.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0651 2.1425 1.0273 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7766 1.7587 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3477 2.6362 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4067 0.4886 0.2467 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0534 2.1795 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6326 0.0183 -1.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6347 2.0299 -1.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8079 -0.3086 1.3372 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2421 -1.2141 -1.3092 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2135 1.3596 0.1764 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5574 0.2911 -0.6515 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1221 1.2533 1.1786 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4187 -1.5438 1.0917 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6315 -1.9876 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8603 -0.9777 -0.5695 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9009 2.5692 0.0757 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5886 0.4320 -1.5801 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3044 -1.9838 0.2883 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.1852 -1.3628 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9322 2.7102 -0.8529 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 1.6416 -1.6808 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6201 -3.1976 0.3529 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0477 -2.3991 -1.2984 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4917 -3.4053 -0.4404 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7767 -2.8969 1.9174 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1469 2.6966 1.9832 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2061 3.6586 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7988 2.8823 2.7317 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1869 1.1921 2.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2101 2.8771 -1.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1812 0.9056 -2.9239 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6499 0.0224 2.3596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1072 2.8385 0.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4075 -1.5608 -2.3237 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -2.1630 1.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1073 -2.9505 -0.3797 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6493 3.4102 0.7169 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -0.3901 -2.2337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3695 -0.4112 -2.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4683 3.6515 -0.9305 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0792 1.7513 -2.4035 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9023 -4.0258 0.9933 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8322 -2.5597 -1.9145 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0427 -4.3496 -0.3905 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -3.1145 2.6631 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -3.7808 1.3358 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6689 -2.5841 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 21 1 0 0 0 0 2 28 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 34 1 0 0 0 0 4 8 1 0 0 0 0 4 15 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 2 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 9 1 0 0 0 0 7 11 2 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 12 2 0 0 0 0 10 33 1 0 0 0 0 11 16 1 0 0 0 0 11 35 1 0 0 0 0 12 17 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 2 0 0 0 0 14 18 1 0 0 0 0 14 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 21 1 0 0 0 0 18 22 2 0 0 0 0 19 23 1 0 0 0 0 19 40 1 0 0 0 0 20 24 1 0 0 0 0 20 41 1 0 0 0 0 21 25 2 0 0 0 0 22 26 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 27 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END $$$$