B8JP6R -OEChem-04022103413D 36 38 0 0 0 0 0 0 0999 V2000 -2.2749 -1.6359 0.2044 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2204 -0.0518 -2.0966 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2916 -0.7201 0.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9215 2.0954 -0.1132 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1709 -2.3291 0.0531 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4313 -2.6449 0.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0828 -2.9465 0.1772 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.4624 0.0428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9829 0.5419 0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5258 0.1706 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9498 -0.9837 0.0225 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5058 -1.3350 0.0971 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4597 0.9182 0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8509 1.2565 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0471 -0.1241 -0.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5571 1.7777 -0.0421 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7621 0.4067 -0.9597 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5554 1.0207 1.3679 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -1.7933 0.1617 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1137 0.7504 -0.9304 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9072 1.3640 1.3974 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6862 1.2291 0.2482 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6483 3.4955 -0.1435 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0647 0.5795 -0.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0018 0.6208 1.0112 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4678 1.3631 0.0245 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0591 -0.5214 -0.0462 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3333 2.8388 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9611 1.1294 2.2712 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7201 0.6452 -1.8251 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3532 1.7362 2.3151 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7386 1.4965 0.2711 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1289 -2.4957 0.0321 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1451 3.8272 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0972 3.7785 -1.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6128 4.0122 -0.1828 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 19 1 0 0 0 0 2 17 1 0 0 0 0 3 12 1 0 0 0 0 3 19 1 0 0 0 0 4 14 1 0 0 0 0 4 23 1 0 0 0 0 5 11 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 12 2 0 0 0 0 7 19 2 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 2 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 15 1 0 0 0 0 13 16 2 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 20 2 0 0 0 0 18 21 1 0 0 0 0 18 29 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 M END $$$$