BD4B2E -OEChem-04022107433D 42 44 0 0 0 0 0 0 0999 V2000 1.5643 0.4362 1.6651 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 0.3172 1.1075 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2757 0.9693 -0.1643 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0022 1.2916 -0.4582 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6105 -0.9692 0.4039 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2633 -3.0015 0.4789 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0822 -3.0112 0.0368 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2841 2.0021 -0.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4581 -0.3583 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2139 -0.9479 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3608 0.1199 -0.3894 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0557 0.0626 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4522 2.6562 -1.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 3.0539 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1377 -2.3209 0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9808 0.2230 0.3827 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4974 -0.1565 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3473 0.1639 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4134 -2.2934 0.5818 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.2152 -2.2272 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7889 -0.0554 -1.1952 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3785 1.7908 2.0666 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6386 0.2429 0.7419 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2363 1.5234 0.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 3.1892 -1.8233 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2775 3.3758 -1.5017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6724 1.9038 -2.2801 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0637 3.6018 0.7168 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 2.5860 1.9155 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8036 3.7820 0.9941 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7902 -0.2840 -2.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2951 -2.8689 0.8426 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2068 -0.3861 -3.2436 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8332 -0.1136 -1.4819 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9372 -2.5311 -0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0934 -4.0095 0.1979 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7476 1.8001 2.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8928 2.3882 1.2893 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 2.2357 2.3184 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2229 0.3868 1.6568 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9184 1.0501 0.0564 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8998 -0.7463 0.3508 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 22 1 0 0 0 0 2 18 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 11 2 0 0 0 0 5 9 2 0 0 0 0 5 19 1 0 0 0 0 6 15 1 0 0 0 0 6 19 2 0 0 0 0 7 15 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 16 18 1 0 0 0 0 17 20 2 0 0 0 0 17 31 1 0 0 0 0 18 21 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$