B0OR7V -OEChem-04042105443D 90 93 0 1 0 0 0 0 0999 V2000 1.0200 1.0264 -0.8099 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1574 1.8654 0.1994 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0634 0.0506 0.3811 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6037 3.2914 -0.0411 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4755 2.4286 -0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 0.1845 1.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6985 -3.0113 0.8692 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1335 -0.3012 -1.9218 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9861 -1.8118 -0.3754 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3643 -0.4662 1.4172 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0305 -1.2238 -0.6259 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4037 0.2626 0.4572 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4181 -0.8213 0.6394 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0175 -2.2705 -0.4106 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0414 -0.0337 0.5039 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1004 0.9823 0.3365 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 1.5749 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 2.5909 0.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5218 2.2946 0.1222 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3327 -1.7024 0.0844 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3197 0.7693 -0.8342 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -0.4650 -1.2875 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1546 -0.7284 -1.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1951 -3.0762 -1.6995 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5939 -1.4432 0.7341 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 1.7402 -0.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0589 0.2424 -0.8796 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6485 0.6737 0.3852 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5936 1.4768 -0.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3359 3.9977 -0.1539 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4052 -0.1907 0.4349 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3095 0.8619 0.2944 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7506 -0.4407 -0.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1252 -2.4410 0.9629 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1904 -1.5026 -1.7449 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6813 0.6146 0.3471 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8728 -1.4907 0.6284 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6496 -2.0541 -1.7976 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5184 -0.0315 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7249 3.0631 0.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1488 -0.6853 0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2445 -1.7379 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9612 0.0822 0.1159 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3357 -1.9181 1.4181 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8012 2.2528 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6480 1.7471 0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9032 -2.6190 0.7785 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7537 -0.6566 0.9945 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5828 -0.9509 0.5965 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1848 -0.4407 1.3282 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0045 -1.6876 1.1661 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6376 -2.9802 0.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2946 -1.5693 -1.2427 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1695 -2.1487 0.1248 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6939 -1.7059 1.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5576 -1.6261 0.4387 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5633 -2.4492 -2.5201 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2493 -3.5297 -2.0171 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9188 -3.8868 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4498 4.5196 0.8013 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2839 4.0440 -0.7002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6389 4.5589 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1680 0.1506 -1.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8118 -3.4258 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1336 -1.9641 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1822 -1.0893 -1.9542 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3061 -2.2769 -0.9796 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7797 -2.0305 -2.8843 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5999 -2.3422 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -2.8696 -1.5407 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 3.0143 1.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1666 3.3701 -0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4399 3.8739 -0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3086 2.7822 0.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9735 4.1375 0.2581 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2892 1.0624 -0.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9531 -2.4935 2.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8763 2.4158 0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6165 2.4352 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4814 3.0206 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7597 2.2799 1.1457 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3239 2.4506 -0.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6395 1.4254 -0.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1428 -3.2230 1.6608 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9192 -3.2539 -0.1135 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8728 -2.2824 0.9273 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6968 -0.2500 1.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0617 2.9845 0.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9874 -3.6596 0.7508 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9506 -1.9855 -0.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 28 1 0 0 0 0 2 17 1 0 0 0 0 2 74 1 0 0 0 0 3 31 1 0 0 0 0 3 39 1 0 0 0 0 4 19 1 0 0 0 0 4 75 1 0 0 0 0 5 29 1 0 0 0 0 5 88 1 0 0 0 0 6 28 2 0 0 0 0 7 42 1 0 0 0 0 7 89 1 0 0 0 0 8 39 2 0 0 0 0 9 49 1 0 0 0 0 9 90 1 0 0 0 0 10 49 2 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 12 17 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 20 1 0 0 0 0 14 24 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 19 2 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 20 33 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 27 1 0 0 0 0 23 38 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 29 1 0 0 0 0 26 40 1 0 0 0 0 27 29 2 0 0 0 0 27 39 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 37 2 0 0 0 0 32 36 2 0 0 0 0 32 45 1 0 0 0 0 33 43 1 0 0 0 0 33 63 1 0 0 0 0 34 44 2 0 0 0 0 34 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 36 41 1 0 0 0 0 36 46 1 0 0 0 0 37 42 1 0 0 0 0 37 47 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 38 70 1 0 0 0 0 40 71 1 0 0 0 0 40 72 1 0 0 0 0 40 73 1 0 0 0 0 41 42 2 0 0 0 0 41 49 1 0 0 0 0 43 48 2 0 0 0 0 43 76 1 0 0 0 0 44 48 1 0 0 0 0 44 77 1 0 0 0 0 45 78 1 0 0 0 0 45 79 1 0 0 0 0 45 80 1 0 0 0 0 46 81 1 0 0 0 0 46 82 1 0 0 0 0 46 83 1 0 0 0 0 47 84 1 0 0 0 0 47 85 1 0 0 0 0 47 86 1 0 0 0 0 48 87 1 0 0 0 0 M END $$$$