B9SO7Z -OEChem-04022118283D 55 60 0 0 0 0 0 0 0999 V2000 8.4217 4.7926 -0.0005 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6237 -0.4700 -0.0007 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5162 -1.4182 0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5977 -5.6735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4464 -2.4199 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3503 -0.3909 0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7045 -2.3722 -0.0006 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6378 -4.8041 -0.0009 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3458 -0.0388 0.0007 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8007 1.7305 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1535 -2.6127 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6252 -3.7436 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0271 -3.6190 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9114 -1.3354 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5181 -1.0485 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3589 -5.0805 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7829 -0.3686 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2395 0.9534 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8247 1.0257 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9695 -1.1020 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1978 -0.4410 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8578 -7.0938 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5128 1.6401 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6963 0.3359 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1262 1.9709 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1271 1.9715 1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9796 2.5118 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3539 2.6330 -1.2088 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3547 2.6336 1.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9681 2.9645 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8937 3.9042 0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2282 1.8902 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0564 4.6747 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3909 2.6606 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3050 4.0529 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5579 -5.6541 0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9213 1.6304 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9705 -2.1891 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6566 0.7087 0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0679 2.7740 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1137 -1.0274 0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4291 -7.3387 -0.8977 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -7.3372 0.8996 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9106 -7.6386 0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 1.7199 -2.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6628 1.7211 2.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9297 2.2553 0.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8316 2.8906 -2.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8332 2.8918 2.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9240 3.4801 -0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 4.4012 0.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 0.8196 -0.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 5.7587 0.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3640 2.1782 -0.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 1 36 1 0 0 0 0 2 25 2 0 0 0 0 3 6 1 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 4 8 1 0 0 0 0 4 16 1 0 0 0 0 4 23 1 0 0 0 0 5 11 2 0 0 0 0 5 15 1 0 0 0 0 6 15 2 0 0 0 0 7 13 1 0 0 0 0 7 14 2 0 0 0 0 8 13 2 0 0 0 0 9 14 1 0 0 0 0 9 25 1 0 0 0 0 9 40 1 0 0 0 0 10 25 1 0 0 0 0 10 28 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 15 17 1 0 0 0 0 16 37 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 18 24 1 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 26 29 1 0 0 0 0 26 46 1 0 0 0 0 27 30 2 0 0 0 0 27 47 1 0 0 0 0 28 32 2 0 0 0 0 28 33 1 0 0 0 0 29 31 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 32 34 1 0 0 0 0 32 52 1 0 0 0 0 33 35 2 0 0 0 0 33 53 1 0 0 0 0 34 36 2 0 0 0 0 34 54 1 0 0 0 0 35 36 1 0 0 0 0 35 55 1 0 0 0 0 M END $$$$