B48JXB -OEChem-04022114093D 61 63 0 0 0 0 0 0 0999 V2000 2.3167 -2.8981 0.0294 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2475 1.2981 0.1657 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6300 2.8653 -0.1261 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4338 -1.5830 -0.3268 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9908 0.1446 0.1599 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6079 2.2110 -0.3444 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3809 -1.1817 0.4555 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.0326 0.4198 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -2.5146 0.6754 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3663 -0.9792 1.6306 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2218 -1.2545 -0.8425 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1999 -0.2830 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4806 -2.7245 -0.3224 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2936 0.2229 1.4462 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -0.0584 -1.0309 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8045 -1.7944 -0.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1984 0.8344 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6909 -0.5780 -0.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4329 2.0121 0.6922 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1672 0.3441 -0.8773 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1485 -0.9673 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0985 0.2316 -0.1779 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6428 2.6566 0.4909 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3442 1.0634 -1.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5568 -0.2065 -0.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5519 0.9545 -0.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0064 0.5209 0.0862 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9559 1.6959 0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9006 0.0786 1.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8068 0.9283 0.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3081 -3.3656 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1927 -2.5208 1.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8189 -0.8677 2.5749 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9866 -1.8800 1.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8357 -2.1656 -0.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5855 -1.3431 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5684 -0.2879 -1.6015 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5151 0.5384 -0.4978 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0542 -3.6470 -0.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8641 -2.8443 -1.3415 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7226 1.1565 1.5124 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0121 0.2149 2.2758 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7649 -0.2508 -1.9227 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5841 0.8534 -1.2362 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5542 -0.1095 -1.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4049 0.1324 0.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2838 -1.4519 0.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4328 -1.7069 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 2.4487 1.3711 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0311 -0.5781 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8473 0.9628 0.5997 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9678 0.7291 -1.1463 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8733 3.5807 1.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1331 0.7217 -1.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 -0.9375 -0.8017 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 -0.7186 0.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4413 1.4623 -1.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2957 1.6955 0.6724 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1289 0.0341 1.0598 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2824 -0.1852 -0.7044 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8691 2.0561 0.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 28 1 0 0 0 0 2 61 1 0 0 0 0 3 28 2 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 16 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 23 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 13 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 14 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 18 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 23 1 0 0 0 0 19 49 1 0 0 0 0 20 24 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 25 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 M END $$$$