RDKit 3D 54 57 0 0 0 0 0 0 0 0999 V2000 6.2320 0.4701 1.4707 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0768 1.0308 2.4358 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5397 1.8046 3.4591 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1631 2.0143 3.5286 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 1.4615 2.5551 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8456 0.6840 1.5189 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 0.0992 0.4956 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7037 0.1702 0.3211 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9106 0.6973 1.1027 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1876 -0.4675 -0.9071 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8837 -0.9752 -2.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0317 -1.4805 -2.9945 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4179 -1.3919 -2.5867 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8083 -0.6274 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1805 -0.2088 -0.2293 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5434 -0.3792 -0.3426 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1753 -0.9455 -1.2302 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3031 0.2232 0.8428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7909 0.0100 0.7403 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.5112 0.8290 -0.3033 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0097 0.8162 0.0348 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7452 -0.4884 -0.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9441 -0.3430 0.6635 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3484 0.3241 1.8945 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 1.0062 1.4689 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7001 -2.0030 -4.2123 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1226 -1.4005 -4.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2951 -1.1013 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6715 2.5656 4.7673 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.6796 -0.1406 0.6866 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1484 0.8495 2.3802 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7323 2.6057 4.3365 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2614 1.6665 2.6442 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5867 -0.4499 -0.1741 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 0.2668 0.5923 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9912 -0.2950 1.7602 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1133 1.3022 0.9361 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9551 -0.9874 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2538 0.2253 1.6402 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1152 1.8534 -0.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3005 0.4248 -1.2996 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5124 1.6578 -0.4726 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1564 -1.3599 0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0153 -0.6089 -1.3028 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6753 0.3278 0.1991 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4493 -1.2866 0.8878 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0326 1.0468 2.3542 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0575 -0.4186 2.6528 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7416 -3.0970 -4.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2378 -1.6639 -5.1417 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 -2.0570 -4.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1779 -0.4588 -4.5948 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8889 -0.1919 -2.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7792 -1.9494 -2.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 12 26 1 0 26 27 1 0 27 28 1 0 3 29 1 0 6 1 1 0 14 10 2 0 28 11 1 0 25 21 1 0 1 30 1 0 2 31 1 0 4 32 1 0 5 33 1 0 7 34 1 0 15 35 1 0 18 36 1 0 18 37 1 0 19 38 1 0 19 39 1 0 20 40 1 0 20 41 1 0 21 42 1 6 22 43 1 0 22 44 1 0 23 45 1 0 23 46 1 0 24 47 1 0 24 48 1 0 26 49 1 0 26 50 1 0 27 51 1 0 27 52 1 0 28 53 1 0 28 54 1 0 M CHG 1 19 1 M END