BO1VA0 -OEChem-04042104233D 56 58 0 0 0 0 0 0 0999 V2000 -0.6860 -3.4729 -0.7337 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6992 -0.3270 -1.9202 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3081 3.8473 -0.7763 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9135 1.6507 -1.0412 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4235 -4.5499 -0.0917 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2545 -3.6097 -2.1155 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7087 -3.6980 1.1138 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1766 -2.8275 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2485 2.4338 0.2133 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8434 1.1523 0.2654 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3117 2.6800 0.3678 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8349 -2.8326 1.3563 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3191 2.8281 -0.6988 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.4326 1.2256 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2804 1.6760 -0.9823 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0925 1.3629 1.5056 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0175 3.0042 0.0753 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0767 0.5051 0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0691 2.5367 1.0515 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4858 -0.2323 -0.8387 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 0.5952 1.3925 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8543 1.6276 -0.4153 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7212 -0.8798 -0.8295 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1384 -0.0525 1.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0062 3.9700 0.5114 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0851 0.3749 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5476 -0.7899 0.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -1.9992 -0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3111 -0.6347 0.4526 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5816 -1.8218 0.3878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1293 0.1973 -1.4833 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3999 -0.9897 -1.5482 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7507 -3.1572 0.2636 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8498 3.6622 -0.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8952 3.2029 -1.6365 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 1.6549 2.1612 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2301 0.4659 0.8559 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7385 0.8763 -1.5019 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0707 2.0509 -1.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4275 2.2951 1.9767 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2633 0.5434 2.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0466 3.1816 1.9365 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9204 1.5102 1.3799 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6213 1.1740 2.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0394 -1.4540 -1.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7837 0.0202 2.2723 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2989 4.0871 1.5589 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9037 3.9899 -0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3489 4.7925 0.2216 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5098 -1.2935 0.2975 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0576 -0.4913 1.2314 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9441 0.9776 -2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6545 -1.0971 -2.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3906 -4.0413 0.2246 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2837 -2.2959 -0.1443 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4422 -2.9679 1.2928 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 1 33 1 0 0 0 0 2 20 1 0 0 0 0 3 17 2 0 0 0 0 4 22 2 0 0 0 0 7 12 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 9 17 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 11 22 1 0 0 0 0 11 25 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 21 44 1 0 0 0 0 22 26 1 0 0 0 0 23 27 1 0 0 0 0 23 45 1 0 0 0 0 24 27 2 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 29 2 0 0 0 0 26 31 1 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 M CHG 2 7 -1 12 1 M END $$$$