L1BF2D -OEChem-05032300532D 90 97 0 1 0 0 0 0 0999 V2000 2.4964 -6.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5214 -6.3329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 -3.2237 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.3875 -4.8329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -0.5983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8638 -2.1766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9318 -6.6376 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5154 -5.8329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3575 5.5796 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6633 5.9398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6554 -4.8329 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6773 -4.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1554 -3.9668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5727 -3.6304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4475 -5.8110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5101 -2.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5214 -5.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4606 -3.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2544 -2.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -2.2455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5316 -2.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -1.5764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2209 -3.8714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2535 -5.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4158 0.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2885 -7.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2424 -4.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3179 0.6889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1195 -4.8329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9856 -5.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9318 -5.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5748 1.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6237 1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2535 -6.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8852 -2.3828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5746 -3.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9856 -6.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1195 -6.8329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7827 2.3362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7338 2.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0396 3.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9417 3.6233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2475 3.9835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1985 4.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4064 5.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5654 6.5578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8712 6.9179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8223 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0573 -4.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6125 -5.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -4.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5703 -3.5061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3812 -3.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9663 -3.7593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5338 -6.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0671 -5.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4766 -3.3337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3733 -3.6391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0803 -3.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8297 -1.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9268 -1.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2691 -2.4778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0228 -1.7198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3875 -4.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6350 -4.3329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1963 -0.9032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7296 -0.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 0.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0873 -0.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6821 -6.9693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1596 -7.7046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -7.2271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8928 0.4566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6465 1.2147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1195 -4.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 1.4639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7166 -6.6429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4712 -1.9213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9679 -3.4612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1195 -7.4529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1244 -7.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1945 2.2303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4499 2.8137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5313 3.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7867 4.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1551 6.7494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4105 7.3328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9512 7.8334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 28 1 0 0 0 0 2 18 2 0 0 0 0 3 23 2 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 4 21 1 0 0 0 0 5 18 1 0 0 0 0 5 25 1 0 0 0 0 5 66 1 0 0 0 0 6 23 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 22 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 83 1 0 0 0 0 9 33 2 0 0 0 0 10 47 2 0 0 0 0 10 48 1 0 0 0 0 11 47 1 0 0 0 0 11 49 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 18 1 6 0 0 0 13 15 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 22 1 0 0 0 0 17 59 1 0 0 0 0 19 20 1 0 0 0 0 19 60 1 0 0 0 0 19 61 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 23 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 22 24 1 0 0 0 0 24 29 2 0 0 0 0 24 67 1 0 0 0 0 25 31 2 0 0 0 0 25 36 1 0 0 0 0 26 30 1 0 0 0 0 26 68 1 0 0 0 0 26 69 1 0 0 0 0 27 35 1 0 0 0 0 27 70 1 0 0 0 0 27 71 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 33 1 0 0 0 0 29 38 1 0 0 0 0 30 34 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 31 32 1 0 0 0 0 31 77 1 0 0 0 0 32 33 1 0 0 0 0 32 39 2 0 0 0 0 34 35 2 0 0 0 0 34 41 1 0 0 0 0 35 78 1 0 0 0 0 36 40 2 0 0 0 0 36 79 1 0 0 0 0 37 38 2 0 0 0 0 37 80 1 0 0 0 0 38 81 1 0 0 0 0 39 40 1 0 0 0 0 40 82 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 42 44 1 0 0 0 0 42 84 1 0 0 0 0 43 45 2 0 0 0 0 43 85 1 0 0 0 0 44 46 2 0 0 0 0 44 86 1 0 0 0 0 45 46 1 0 0 0 0 45 87 1 0 0 0 0 46 47 1 0 0 0 0 48 50 2 0 0 0 0 48 88 1 0 0 0 0 49 50 1 0 0 0 0 49 89 1 0 0 0 0 50 90 1 0 0 0 0 M END $$$$