BE0JG1 -OEChem-04012112552D 83 86 0 1 0 0 0 0 0999 V2000 8.9774 0.6198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.0658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8836 -1.3273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3543 -2.1404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5127 -1.0275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4148 -0.4095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.4342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.9342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.9342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.4342 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7036 -2.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6818 -2.6367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1818 -1.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6716 0.2597 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7206 -0.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8795 1.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8306 1.5468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1364 1.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8843 -1.2924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5737 0.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3443 2.8851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0385 2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1853 1.5979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3531 -2.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5248 1.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6012 3.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9896 2.8340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4422 2.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7327 2.1649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6501 3.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8226 -3.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2361 -1.7408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4702 -2.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6316 -0.8151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0836 -2.4288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6388 -3.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4902 -3.2263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2482 -2.8888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6834 -2.1351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5967 -1.3099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5427 -0.3468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2899 1.0462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0044 -0.2179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 -0.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 -0.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4448 0.2713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9340 3.0767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5778 2.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0564 0.9915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9855 0.7719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7301 4.1607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1185 3.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8525 2.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3224 2.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1893 3.6601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2752 -3.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1137 -3.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3700 -2.8021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5271 -2.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7835 -1.4497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9450 -1.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1791 -2.1323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9228 -2.9708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7613 -3.2271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 0.0658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 0.0658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -3.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -3.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -2.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.5542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 17 2 0 0 0 0 3 21 1 0 0 0 0 3 27 1 0 0 0 0 4 21 2 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 14 6 1 1 0 0 0 6 21 1 0 0 0 0 6 52 1 0 0 0 0 7 17 1 0 0 0 0 7 20 1 0 0 0 0 7 53 1 0 0 0 0 8 35 1 0 0 0 0 8 42 2 0 0 0 0 9 42 1 0 0 0 0 9 82 1 0 0 0 0 9 83 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 1 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 50 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 51 1 0 0 0 0 18 22 2 0 0 0 0 18 24 1 0 0 0 0 19 23 2 0 0 0 0 19 25 1 0 0 0 0 20 26 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 22 28 1 0 0 0 0 22 56 1 0 0 0 0 23 29 1 0 0 0 0 23 57 1 0 0 0 0 24 30 2 0 0 0 0 24 58 1 0 0 0 0 25 31 2 0 0 0 0 25 59 1 0 0 0 0 26 32 1 0 0 0 0 26 35 2 0 0 0 0 27 36 1 0 0 0 0 27 37 1 0 0 0 0 27 38 1 0 0 0 0 28 33 2 0 0 0 0 28 60 1 0 0 0 0 29 34 2 0 0 0 0 29 61 1 0 0 0 0 30 33 1 0 0 0 0 30 62 1 0 0 0 0 31 34 1 0 0 0 0 31 63 1 0 0 0 0 32 39 2 0 0 0 0 32 40 1 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 35 41 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 38 72 1 0 0 0 0 38 73 1 0 0 0 0 38 74 1 0 0 0 0 39 42 1 0 0 0 0 39 75 1 0 0 0 0 40 76 1 0 0 0 0 40 77 1 0 0 0 0 40 78 1 0 0 0 0 41 79 1 0 0 0 0 41 80 1 0 0 0 0 41 81 1 0 0 0 0 M END $$$$