B4RW0I -OEChem-04022107112D 58 62 0 0 0 0 0 0 0999 V2000 4.5124 3.3614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 2.4762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6610 1.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3606 -1.5203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6522 -0.3663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3173 -3.3492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 1.8307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3334 1.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7086 2.7764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3191 1.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 3.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0091 1.8281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 2.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2962 2.9871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6782 1.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6564 1.2929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9654 2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3413 0.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3618 0.7168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6053 3.9381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0281 -0.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6837 1.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0213 -0.4393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0070 0.1752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6733 -0.5705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3185 -1.1120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0058 -2.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2974 -0.9079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6721 -2.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9637 -1.6536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6510 -2.6035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1066 0.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8631 0.7289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7053 1.1722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3001 0.6398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9396 3.5797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1773 3.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6212 2.7354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4516 1.9554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4866 0.4953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1949 3.7465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7968 4.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0156 4.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5010 -0.3554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2581 -0.6046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4339 -0.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8229 -1.0267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6087 -0.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5341 0.5018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7770 0.7510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8461 0.2226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3989 -2.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4913 -0.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4782 -3.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5706 -1.5271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9242 -3.2226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1234 -3.9381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 14 1 0 0 0 0 2 18 1 0 0 0 0 2 23 1 0 0 0 0 3 23 2 0 0 0 0 4 26 2 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 5 52 1 0 0 0 0 6 32 1 0 0 0 0 6 57 1 0 0 0 0 6 58 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 25 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 53 1 0 0 0 0 29 31 2 0 0 0 0 29 54 1 0 0 0 0 30 32 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 M END $$$$