RDKit 3D 56 60 0 0 0 0 0 0 0 0999 V2000 7.7357 1.2520 -1.0679 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6711 0.3661 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9818 -0.9109 -0.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9926 -1.7074 0.5479 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6699 -1.2456 0.6815 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3333 0.0305 0.1775 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3545 0.8309 -0.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0059 0.5543 0.2233 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7304 1.8470 0.6704 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5722 2.6340 1.1037 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3032 2.2802 0.6766 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9744 3.4975 1.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3545 3.9057 1.3804 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3557 3.0981 0.8518 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0352 1.8957 0.2142 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2953 1.4859 0.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6995 0.2811 -0.4996 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0047 -0.1789 -0.4051 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1051 -1.3420 -1.0176 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8853 -1.6587 -1.5439 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -0.6678 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5127 -0.5587 -1.9761 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1539 -2.2062 -1.5479 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6694 -2.2182 -1.6787 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2268 -2.8705 -2.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2764 -1.4547 -0.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6365 -1.1720 -0.4787 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6611 -1.7722 -1.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9988 -1.4641 -0.9592 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -0.5526 0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3101 0.0537 0.7811 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9539 -0.2408 0.5402 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8835 0.4609 1.3635 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2516 1.3740 2.1657 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6737 0.0900 1.1772 O 0 0 0 0 0 1 0 0 0 0 0 0 3.6974 -2.1438 1.4001 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3245 1.9007 -1.8482 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1686 1.8753 -0.2797 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5338 0.6592 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9970 -1.2930 -0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2621 -2.6949 0.9172 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1177 1.8284 -0.7375 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7498 4.1201 1.7373 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6159 4.8326 1.8838 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4047 3.3756 0.9602 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8752 1.2977 -0.1224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8868 -2.4758 -0.5199 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7283 -2.9562 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6585 -0.9379 -0.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4411 -2.4887 -2.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7830 -1.9383 -1.5414 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3616 -0.3077 0.2442 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5662 0.7719 1.5592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8807 -1.5797 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2878 -2.8920 0.7154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2006 -2.6699 2.2197 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 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 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 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 33 35 1 0 5 36 1 0 7 2 1 0 18 8 1 0 16 11 1 0 21 17 1 0 32 27 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 0 4 41 1 0 7 42 1 0 12 43 1 0 13 44 1 0 14 45 1 0 15 46 1 0 23 47 1 0 23 48 1 0 26 49 1 0 28 50 1 0 29 51 1 0 30 52 1 0 31 53 1 0 36 54 1 0 36 55 1 0 36 56 1 0 M CHG 1 35 -1 M END