BZ4KF0 -OEChem-04022106153D 51 54 0 0 0 0 0 0 0999 V2000 -6.2044 2.1126 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2346 -1.4208 1.4378 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9327 -0.4662 1.6556 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2914 -0.5604 2.0987 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6221 -0.2008 0.8584 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4994 2.3628 -1.4385 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1339 2.5561 0.9832 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8952 0.4197 0.1509 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4825 0.3264 -1.7345 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 2.7881 0.3191 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1449 1.4358 -0.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2143 1.4556 0.5139 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5009 -1.9862 0.3615 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5485 -2.3898 -0.3858 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9097 -2.5038 0.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8935 -1.8485 -0.1009 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8096 -1.5155 -0.4607 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0383 -0.9032 0.9102 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3408 -0.9628 1.4347 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4351 -3.3679 -1.5289 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0564 -2.2364 -0.7848 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 -0.3410 1.2435 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9338 -1.0245 0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 -1.0867 -1.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4106 -0.7355 0.5488 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3026 -1.6842 -0.4641 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7308 -0.1135 -0.4805 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3811 -0.1729 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0108 0.9470 0.1873 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2352 2.8165 1.7363 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5553 2.5541 -1.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5611 2.5732 -0.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7646 3.1727 -1.1119 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2924 -2.7545 1.2186 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9667 -3.4563 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9848 -4.2876 -1.3004 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8423 -2.9323 -2.4486 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5869 -3.6617 -1.7725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0267 -2.9760 -1.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3433 0.3951 2.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6615 -1.4469 -2.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1848 -2.0047 -1.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2016 0.1921 -3.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0403 0.0580 1.1034 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9032 2.6050 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0143 3.2404 2.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3451 3.4466 1.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9771 1.8093 2.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8619 2.9523 -2.0876 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 2.9877 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0684 4.0693 -1.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 23 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 19 2 0 0 0 0 5 25 1 0 0 0 0 5 29 1 0 0 0 0 8 27 1 0 0 0 0 8 44 1 0 0 0 0 9 27 2 0 0 0 0 9 28 1 0 0 0 0 10 30 1 0 0 0 0 10 45 1 0 0 0 0 11 29 1 0 0 0 0 11 31 2 0 0 0 0 12 29 2 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 15 17 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 18 2 0 0 0 0 16 21 1 0 0 0 0 17 23 2 0 0 0 0 17 24 1 0 0 0 0 18 22 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 26 2 0 0 0 0 21 39 1 0 0 0 0 22 25 2 0 0 0 0 22 40 1 0 0 0 0 23 27 1 0 0 0 0 24 28 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 28 43 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 31 33 1 0 0 0 0 31 49 1 0 0 0 0 32 33 2 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 M END $$$$