RDKit 3D 50 52 0 0 0 0 0 0 0 0999 V2000 -1.4461 -1.2147 1.9519 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3938 -0.2613 1.4628 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4721 -0.7319 0.7553 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8037 -2.0938 0.6821 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9279 -2.5219 -0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7386 -1.5966 -0.6734 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4226 -0.2399 -0.6099 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2902 0.2121 0.0958 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0351 1.6982 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8942 2.4339 -0.4195 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7837 2.1233 0.4973 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2864 3.3849 0.7732 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1335 4.8261 0.7592 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9714 3.4336 1.1811 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0514 2.4706 1.0644 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.5142 0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0654 0.5257 0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0319 0.5159 1.0374 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0595 1.5062 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0772 2.4982 2.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2073 -0.8668 1.1252 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4243 -1.9641 0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4026 -0.9961 2.5717 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5138 -0.4107 0.3247 N 0 0 0 0 0 2 0 0 0 0 0 0 4.4141 -0.2121 -1.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3588 -1.2318 -1.9701 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2498 -0.9850 -3.3036 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 0.3217 -3.6355 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2684 1.3386 -2.6999 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3886 1.0992 -1.3785 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5369 -2.5409 -1.5744 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6932 -3.4156 -2.3121 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0403 -1.8226 1.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6199 -0.6631 2.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8935 -1.8401 2.7307 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2042 -2.8538 1.1743 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1651 -3.5812 -0.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6141 -1.9257 -1.2277 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0641 0.4733 -1.1254 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2119 1.3808 0.8823 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7288 4.2868 1.6726 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6406 1.5227 -0.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0782 -0.2372 -0.7409 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8266 1.4860 2.7881 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0932 3.2479 2.8024 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0997 0.5364 -4.6925 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2315 2.3811 -2.9874 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6575 -3.0554 -2.3448 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6919 -4.3851 -1.8054 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0822 -3.5701 -3.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 8 9 1 0 9 10 2 0 9 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 18 21 1 0 21 22 2 0 21 23 2 0 21 24 1 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 26 31 1 0 31 32 1 0 8 3 1 0 20 15 1 0 30 25 1 0 1 33 1 0 1 34 1 0 1 35 1 0 4 36 1 0 5 37 1 0 6 38 1 0 7 39 1 0 11 40 1 0 14 41 1 0 16 42 1 0 17 43 1 0 19 44 1 0 20 45 1 0 28 46 1 0 29 47 1 0 32 48 1 0 32 49 1 0 32 50 1 0 M CHG 1 24 -1 M END