B4K0IJ -OEChem-04022104303D 40 43 0 1 0 0 0 0 0999 V2000 5.0395 0.7046 -0.6763 P 0 0 2 0 0 0 0 0 0 0 0 0 1.5313 -0.3198 1.6338 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -0.2792 -1.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9821 0.7896 0.9458 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0796 -2.4271 -0.7228 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5643 2.1743 -1.1614 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3792 0.2987 -1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5524 -0.2501 0.4816 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9455 1.4869 0.3622 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1114 -2.0640 0.0565 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9076 1.1084 -0.2107 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3759 -1.2234 -0.2921 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6079 -0.0989 -0.4110 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8426 -0.2609 1.0763 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5184 -1.1201 -0.6454 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6970 -0.9926 0.6518 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7137 0.8636 1.5987 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7866 -0.7721 0.2158 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6997 1.1096 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6357 0.3208 0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9763 0.0596 -0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4326 -2.1912 -0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2869 0.8912 -0.4798 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0632 2.1919 -0.4825 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2034 0.8959 -0.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -1.2120 1.2822 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9548 -0.9418 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4332 -1.9703 1.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2651 1.8477 1.4263 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8679 0.7632 2.6775 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3414 -3.0544 -0.8078 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1279 1.7767 0.7608 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7136 2.5412 -0.8404 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7879 -3.2060 -0.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5595 2.0516 -0.0778 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4103 0.4052 -1.4547 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7214 0.2271 0.2768 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9879 2.6967 0.4865 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6797 2.8769 -1.2462 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1217 2.0065 -0.6901 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 1 7 2 0 0 0 0 2 14 1 0 0 0 0 2 16 1 0 0 0 0 3 13 1 0 0 0 0 4 17 1 0 0 0 0 5 15 1 0 0 0 0 5 31 1 0 0 0 0 6 33 1 0 0 0 0 8 16 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 19 2 0 0 0 0 9 20 1 0 0 0 0 10 18 2 0 0 0 0 10 22 1 0 0 0 0 11 21 1 0 0 0 0 11 23 1 0 0 0 0 11 35 1 0 0 0 0 12 21 1 0 0 0 0 12 22 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 14 17 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$