B86UHF -OEChem-04012114502D 35 38 0 0 0 0 0 0 0999 V2000 3.6526 -1.7538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5106 2.5041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3692 -1.7234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2962 1.1298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0091 -0.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 0.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7086 0.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9654 0.3866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5124 1.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6564 -0.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6782 -0.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3334 -0.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6053 2.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 1.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3413 -1.3492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3191 -0.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6837 -0.1498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3618 -1.1405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9914 -2.5041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1949 1.8892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7968 2.6705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0156 2.2724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5152 1.7428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1655 1.2107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1429 -1.9366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9056 -1.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3942 0.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2897 -0.0186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7749 -1.6028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5263 -2.0942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5815 -2.9692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4566 -2.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 22 1 0 0 0 0 2 10 2 0 0 0 0 3 12 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 9 11 1 0 0 0 0 9 16 2 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 13 18 2 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 19 2 0 0 0 0 15 26 1 0 0 0 0 16 20 1 0 0 0 0 16 27 1 0 0 0 0 17 21 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$