RDKit 3D 52 54 0 0 0 0 0 0 0 0999 V2000 2.8874 -2.5845 -1.7197 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5642 -1.2224 -1.1635 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5577 -0.5451 -0.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3234 0.7088 0.1153 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3628 1.4152 0.8764 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6152 1.6933 0.3033 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6033 2.3659 1.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3558 2.7701 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1219 2.5030 2.9226 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1332 1.8316 2.1986 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0601 1.2607 -0.0714 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0673 0.5864 -0.7986 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2777 1.2484 -0.9566 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3456 -0.6303 -1.3649 N 0 0 0 0 0 4 0 0 0 0 0 0 0.3033 -1.3239 -2.1792 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -2.1408 -1.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3356 -2.4088 -0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7122 -2.5080 -1.9601 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7353 -3.1404 -1.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6138 -2.0696 -0.5775 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5293 -1.3765 -1.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3305 -0.3694 -0.8433 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -0.0430 0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2588 1.1970 1.2091 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3524 2.5939 0.9632 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3185 1.0143 2.6394 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4346 1.3386 0.3846 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3032 -0.7256 1.3267 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5048 -1.7322 0.7803 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8048 -2.9888 -1.2786 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0888 -3.2974 -1.4966 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0342 -2.5206 -2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5299 -1.0173 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8352 1.3996 -0.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5670 2.5772 0.5691 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1254 3.2926 2.8998 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 2.8151 3.9469 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1837 1.6261 2.6888 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8426 2.2419 0.3531 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3899 2.0929 -0.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3894 1.6288 -1.9762 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0881 0.5497 -0.7324 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7815 -1.9626 -2.9243 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2714 -0.5660 -2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3261 -3.7759 -1.8415 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3103 -3.8032 -0.4087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6368 -1.6284 -2.4388 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0538 0.1445 -1.4739 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1412 3.0103 1.8724 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8816 3.2248 0.3574 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -0.4895 2.3864 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8047 -2.2603 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 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 4 11 2 0 11 12 1 0 12 13 1 0 12 14 2 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 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 1 0 24 26 2 0 24 27 2 0 23 28 1 0 28 29 2 0 10 5 1 0 14 2 1 0 29 20 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 0 6 34 1 0 7 35 1 0 8 36 1 0 9 37 1 0 10 38 1 0 11 39 1 0 13 40 1 0 13 41 1 0 13 42 1 0 15 43 1 0 15 44 1 0 19 45 1 0 19 46 1 0 21 47 1 0 22 48 1 0 25 49 1 0 25 50 1 0 28 51 1 0 29 52 1 0 M CHG 1 14 1 M END