B2CR6A -OEChem-04042107353D 49 52 0 1 0 0 0 0 0999 V2000 -8.3999 0.9315 1.0539 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0632 0.1549 2.3548 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7634 0.1095 0.0525 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5394 -0.3000 -0.1413 N 0 0 3 0 0 0 0 0 0 0 0 0 2.3662 1.6434 -0.7218 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8633 3.4826 0.4168 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2657 -2.5113 1.3965 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4119 0.2272 -1.2401 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6646 -0.6337 -1.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0021 0.4584 0.9899 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 -0.0224 0.0867 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5213 0.2041 1.2125 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3116 1.3377 0.0681 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8976 -0.6206 -0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0574 0.7789 -1.6486 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0089 2.4656 0.7622 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6681 2.9544 -0.4782 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8804 0.2126 0.3873 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3514 -1.7940 -0.8501 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1976 0.0583 -0.9814 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2364 -0.1087 0.3285 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7075 -2.1153 -0.9088 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -1.2725 -0.3196 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 -1.1757 -0.3868 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4592 0.6370 -0.9709 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0305 -1.8440 0.2305 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5168 -0.0311 -0.3539 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3024 -1.2715 0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3852 -1.9553 0.8809 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7302 -0.0839 -2.0388 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6604 1.2842 -1.3931 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3837 -1.6922 -1.2023 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1784 -0.4737 -2.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5152 0.1748 1.9172 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1414 1.5333 0.8265 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9755 -0.6755 -0.7361 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9724 -0.5209 1.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3503 0.0859 -2.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4314 1.4048 -2.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 2.6218 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4776 3.4694 -0.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5803 1.1321 0.8869 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6435 -2.4795 -1.3105 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0296 -3.0228 -1.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7033 -1.5358 -0.3729 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9964 -1.6465 -0.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 1.6026 -1.4356 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8485 -2.8118 0.6917 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5024 0.4282 -0.3489 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 12 2 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 16 1 0 0 0 0 6 17 2 0 0 0 0 7 29 3 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 13 16 2 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 21 1 0 0 0 0 18 42 1 0 0 0 0 19 22 2 0 0 0 0 19 43 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 25 27 2 0 0 0 0 25 47 1 0 0 0 0 26 28 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 M END $$$$