RDKit 3D 55 58 0 0 0 0 0 0 0 0999 V2000 7.1196 0.7088 3.2617 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9164 0.7620 2.3275 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2520 2.1348 2.3477 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4045 2.9382 3.2695 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3285 2.4300 1.3788 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0967 1.7104 0.1992 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9957 2.0775 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7354 1.3931 -1.7716 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5829 0.3744 -2.2106 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6932 0.0272 -1.4392 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9528 0.6854 -0.2299 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4352 0.2666 0.6580 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 1.8466 -2.7639 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7307 1.7856 -4.1518 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 3.0036 -2.1827 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3039 0.5370 -2.5291 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 0.4997 -1.3585 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 1.2517 -1.6386 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0136 0.3116 -2.0193 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2839 -0.6784 -0.9079 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.0586 -1.0900 -0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8139 -0.9638 -0.9742 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4407 -0.2541 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9044 -1.3538 0.8995 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5849 -1.3270 2.2657 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9872 -2.3660 3.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -3.4386 2.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0411 -3.4734 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6411 -2.4372 0.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8834 1.4438 2.9821 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5794 -0.2856 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8173 0.9357 4.2908 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1689 0.0399 2.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8325 3.2987 1.5404 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3468 2.8914 -0.2655 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.1351 -3.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3682 -0.7486 -1.7979 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0728 0.0683 -3.4062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0702 0.9913 -0.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7582 1.9993 -2.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1761 1.8050 -0.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9392 0.8549 -2.2353 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7547 -0.2777 -2.9065 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6211 -1.5340 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9877 -0.4410 0.7661 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2141 -2.1256 0.2051 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9132 -1.5978 -1.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0585 -1.3426 -0.4277 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1174 0.6350 0.5378 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2691 0.0382 -0.6723 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0287 -0.4982 2.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7452 -2.3393 4.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0318 -4.2441 3.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6209 -4.3076 0.8479 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9293 -2.4863 -0.6542 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 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 8 13 1 0 13 14 2 0 13 15 2 0 13 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 12 2 1 0 11 6 1 0 22 17 1 0 29 24 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 1 5 34 1 0 7 35 1 0 9 36 1 0 10 37 1 0 16 38 1 0 17 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 20 44 1 0 21 45 1 0 21 46 1 0 22 47 1 0 22 48 1 0 23 49 1 0 23 50 1 0 25 51 1 0 26 52 1 0 27 53 1 0 28 54 1 0 29 55 1 0 M CHG 1 20 1 M END