BJI52M -OEChem-04042103473D 48 51 0 0 0 0 0 0 0999 V2000 6.8144 -0.2095 0.3061 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2173 0.1264 0.4611 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1494 -1.0701 1.2648 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8861 1.8388 -0.5097 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1506 -1.3931 0.9237 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2400 -0.4101 -1.0962 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9194 1.2540 0.0851 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7136 -1.1068 -1.3199 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6678 -2.5953 -1.1528 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 -1.8356 -1.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4963 1.1409 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8056 1.2347 -1.1422 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7967 0.9365 1.2554 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7156 0.9195 0.0283 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4153 1.1240 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4065 0.8258 1.2365 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2484 0.8032 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4524 -0.4113 0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9261 -0.3809 0.4711 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.8076 -0.4489 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5687 0.7463 -0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6737 -1.4664 0.9354 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9623 0.7947 -0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7106 -0.2875 0.3741 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0675 -1.4154 0.8852 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1378 -0.2411 0.3235 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3376 -0.2021 0.2801 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7983 -0.1542 0.2294 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6579 -0.3729 -1.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2021 -0.6724 -2.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1142 -3.1992 -1.9349 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7436 -3.0423 -0.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 -1.9343 -2.5028 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6436 -1.7877 -0.7386 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2869 1.8627 -0.6589 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3404 1.3915 -2.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3212 0.8718 2.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8959 1.1940 -2.1137 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8772 0.6733 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1193 2.7419 -0.8294 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1924 -2.3538 1.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4568 1.6773 -0.4894 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6401 -2.2655 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2183 -0.9064 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1487 0.8342 0.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9389 -0.5756 -2.2277 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0352 0.6163 -0.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1054 -1.1401 -0.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 18 2 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 11 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 15 1 0 0 0 0 12 36 1 0 0 0 0 13 16 2 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 1 0 0 0 0 22 25 2 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 3 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 M END $$$$