B3F2UW -OEChem-04022113413D 42 45 0 1 0 0 0 0 0999 V2000 4.1840 2.1039 -0.0188 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8817 2.2994 0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7595 -1.7235 -1.1327 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5631 -2.0567 -0.3103 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2049 -0.6029 -0.2637 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2471 -2.3801 1.0317 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4056 -1.3540 1.0633 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9079 -0.6892 -0.2216 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9254 0.1897 -0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4575 -0.5077 -0.1604 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.6329 -0.0058 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1889 0.2701 -1.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2793 -1.1141 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5721 0.4413 -1.0646 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6624 -0.9429 0.9135 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3088 -0.1653 -0.0472 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7438 0.0104 0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3318 3.5191 0.1365 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2877 1.0749 0.7287 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5832 -0.8845 -0.6531 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6712 1.2446 0.7842 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9666 -0.7149 -0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5106 0.3496 0.1209 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9461 -2.8511 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0837 -0.0878 -0.6543 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6493 -3.3999 1.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5828 -2.2627 1.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3419 -0.6978 1.9381 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3693 -1.8759 1.0872 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4347 -2.4877 -1.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 0.7453 -1.9253 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2048 -1.7220 1.6167 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0606 1.0493 -1.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2218 -1.4226 1.7133 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3988 3.7551 0.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8321 4.0433 -0.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9273 3.8372 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6477 1.7818 1.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1757 -1.7198 -1.2179 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0949 2.0735 1.3437 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6204 -1.4117 -1.1143 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5877 0.4816 0.1639 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 18 1 0 0 0 0 2 11 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 30 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 24 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 15 2 0 0 0 0 13 32 1 0 0 0 0 14 16 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 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 23 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$