B1RQV7 -OEChem-04022115413D 46 48 0 1 0 0 0 0 0999 V2000 1.2571 0.7728 0.4532 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6429 0.2622 -0.2293 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6141 2.9124 0.5583 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7247 0.5709 2.0096 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2779 0.2383 -0.4528 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7089 0.4075 -1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9923 -0.3796 -2.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 0.9327 -0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9729 -0.1239 -1.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5548 0.4194 0.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2527 0.2568 -0.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0332 2.2699 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2662 -1.1766 -0.7625 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -0.4563 -1.2094 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4553 0.9178 -0.0871 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4814 0.6628 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2359 2.9310 0.4582 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 2.2549 0.3102 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2445 -0.2238 -0.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8244 0.3393 1.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5671 -2.1212 0.3735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1236 -3.3812 0.5447 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4645 -4.2709 1.7063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2178 -4.0154 -0.4775 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2067 -0.8213 -0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8986 1.4691 -2.1222 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0648 0.0727 -2.6119 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7699 -1.4531 -2.1766 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4218 -0.0936 -3.1123 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1059 2.8258 0.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 -1.3089 -1.5381 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3545 -1.4542 -1.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6649 -0.8936 -2.1441 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1488 1.0996 2.1408 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2151 3.9736 0.7641 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2892 -0.4820 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2338 -1.7408 1.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5318 -0.6733 -0.4488 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4129 3.8268 0.8218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1077 -3.7598 2.4302 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5537 -4.5805 2.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9933 -5.1653 1.3621 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2421 -3.5325 -1.4571 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5176 -5.0555 -0.6498 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -4.0165 -0.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2614 0.9630 2.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 10 1 0 0 0 0 2 15 1 0 0 0 0 2 38 1 0 0 0 0 3 18 1 0 0 0 0 3 39 1 0 0 0 0 4 20 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 16 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 12 17 2 0 0 0 0 12 30 1 0 0 0 0 13 21 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 19 2 0 0 0 0 14 33 1 0 0 0 0 15 18 2 0 0 0 0 16 20 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 24 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 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END $$$$