RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 3.0293 -3.5689 -1.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -2.1069 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 -1.5230 -0.0655 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8515 -0.1563 0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8558 0.6266 -0.3698 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9244 0.0684 -1.2459 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9794 -1.2978 -1.5245 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8053 2.4119 -0.0116 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1134 2.9498 -1.1859 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2337 2.7386 0.0153 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0693 2.6198 1.4055 N 0 0 0 0 0 2 0 0 0 0 0 0 0.8502 2.0282 1.4891 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3228 2.4634 0.8922 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4037 1.5191 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9905 0.4737 1.9681 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 0.6615 2.4717 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7692 -0.7157 2.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1304 -1.7098 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1324 -2.3102 0.5948 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4651 -3.2378 -0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7979 -3.5827 -0.6065 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7989 -3.0008 0.1691 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4677 -2.0716 1.1575 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7861 1.6683 0.5991 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 3.6921 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1258 4.8086 0.4954 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0453 3.4562 -1.1135 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0123 4.5843 -1.9802 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6865 -3.7308 -2.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0369 -3.9686 -1.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4148 -4.1372 -0.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6782 -2.1262 0.3922 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5778 0.3014 0.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1595 0.6944 -1.6969 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2491 -1.7222 -2.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -0.3479 2.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2196 -1.2588 3.2431 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0865 -2.0439 0.7443 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6798 -3.6824 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -4.3010 -1.3794 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8387 -3.2672 0.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2605 -1.6253 1.7527 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0831 2.7210 0.5566 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5268 1.1560 1.2203 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8352 1.2493 -0.4109 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3869 4.2707 -2.9587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6654 5.3758 -1.5997 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0104 4.9537 -2.1090 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 2 0 5 6 1 0 6 7 2 0 5 8 1 0 8 9 2 0 8 10 2 0 8 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 14 24 1 0 13 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 7 2 1 0 16 12 1 0 23 18 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 4 33 1 0 6 34 1 0 7 35 1 0 17 36 1 0 17 37 1 0 19 38 1 0 20 39 1 0 21 40 1 0 22 41 1 0 23 42 1 0 24 43 1 0 24 44 1 0 24 45 1 0 28 46 1 0 28 47 1 0 28 48 1 0 M CHG 1 11 -1 M END