RDKit 3D 48 49 0 0 0 0 0 0 0 0999 V2000 -5.6281 -1.0025 1.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4345 -0.0636 1.3417 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4430 0.6117 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2955 1.6316 -0.1605 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1402 1.3350 0.8087 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -0.1297 0.9102 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1119 -0.8207 1.5621 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4388 -0.6851 1.4067 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 0.2463 2.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5184 -2.1029 1.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5191 -0.4972 -0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8935 -1.1491 0.0814 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9219 -0.6658 -0.9409 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1288 -1.6078 -1.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2150 -1.0736 -1.9378 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6347 0.3404 -1.5477 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4394 1.2747 -1.4676 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4208 0.6981 -0.5350 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.8071 1.7011 -1.6089 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5701 -0.4578 1.3826 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6065 -1.8078 0.7627 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6292 -1.4578 2.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5224 0.7180 2.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3982 1.1239 -0.2029 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3618 -0.1583 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6859 2.6255 0.0948 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2263 1.8276 0.4621 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3644 1.7407 1.8033 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -0.9265 2.6389 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1816 -1.8240 1.1237 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 0.5738 -0.2925 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.9793 -0.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -2.2351 -0.0139 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2777 -0.9809 1.0958 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4651 -0.5546 -1.9314 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 -1.7499 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8094 -2.5962 -1.3584 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 -1.7392 -1.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8422 -1.0717 -2.9693 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1461 0.3134 -0.5772 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 0.7260 -2.2769 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7202 2.2540 -1.0677 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9522 1.4083 -2.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8296 0.6498 0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 1.3674 -0.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0527 2.4861 -1.7271 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3594 0.7536 -1.9263 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6358 1.9305 -2.2872 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 8 10 2 0 8 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 4 19 1 0 7 2 1 0 18 13 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 1 3 24 1 0 3 25 1 0 4 26 1 1 5 27 1 0 5 28 1 0 7 29 1 0 7 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 13 35 1 6 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 17 43 1 0 18 44 1 0 18 45 1 0 19 46 1 0 19 47 1 0 19 48 1 0 M CHG 1 18 1 M END