RDKit 3D 50 52 0 0 0 0 0 0 0 0999 V2000 -2.6148 0.7525 3.0207 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6657 -0.1574 3.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1835 -0.6966 1.9157 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7084 -0.3266 0.6501 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6826 0.6199 0.5986 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0997 1.1403 1.7735 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9048 2.0670 1.6805 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3923 2.4698 2.7685 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4822 2.3384 0.5135 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.2462 -0.9502 -0.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -0.6562 -1.7362 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2941 -1.1195 -2.0662 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7378 -0.7587 -3.1002 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7521 -1.9527 -1.1093 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -2.1176 -0.7971 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6298 -1.3935 -1.4331 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9526 -1.5167 -0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2896 -2.3871 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2873 -3.1208 0.6791 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -2.9782 0.2653 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2536 -3.8796 1.1115 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.2422 -0.5691 -1.7601 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4207 -1.4141 -1.7999 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7391 0.0287 -2.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5376 0.6755 -0.6366 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3424 1.5487 -0.3083 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7889 2.8866 0.2993 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6537 3.6596 -0.5591 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 2.8599 -1.5123 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 1.4953 -0.9482 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2245 -1.6990 2.0351 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.2500 -1.3794 2.6557 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0048 -2.8186 1.5483 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.1715 1.1605 3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0484 -0.4546 4.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2637 0.9671 -0.3439 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8104 0.4182 -1.9394 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3787 -1.1647 -2.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4018 -2.3670 -0.4444 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4077 -0.6934 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3219 -2.4770 0.3817 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5412 -3.7837 1.5018 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7239 1.0081 0.4135 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7648 1.7412 -1.2187 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3328 2.7128 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9257 3.5144 0.5367 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 2.7569 -2.4072 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2554 3.4171 -1.8019 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4102 0.9789 -1.6521 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3091 1.6148 -0.0125 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 2 0 7 9 1 0 4 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 17 22 1 0 22 23 2 0 22 24 2 0 22 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 3 31 1 0 31 32 2 0 31 33 1 0 6 1 1 0 20 15 1 0 30 25 1 0 1 34 1 0 2 35 1 0 5 36 1 0 11 37 1 0 11 38 1 0 14 39 1 0 16 40 1 0 18 41 1 0 19 42 1 0 26 43 1 0 26 44 1 0 27 45 1 0 27 46 1 0 29 47 1 0 29 48 1 0 30 49 1 0 30 50 1 0 M CHG 3 9 -1 31 1 33 -1 M END