RDKit 3D 47 49 0 0 0 0 0 0 0 0999 V2000 6.9034 -1.3034 1.6468 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4181 -1.3535 1.9622 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6952 -1.1931 0.7371 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3403 -1.2340 0.8881 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7627 -1.4481 1.9444 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6799 -1.0464 -0.4347 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0814 -0.2739 -1.4594 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2054 -0.3595 -2.6991 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9054 -1.1179 -2.3393 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2196 -1.9393 -0.7447 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2507 -0.2628 -2.2131 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7737 0.3850 -3.3057 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1808 0.3928 -4.3876 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1234 1.0515 -3.1317 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0428 2.4375 -1.9693 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5535 1.5498 -0.5084 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5233 1.9472 0.3113 N 0 0 0 0 0 2 0 0 0 0 0 0 -3.7503 0.8933 1.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9143 -0.1303 0.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1108 0.3173 -0.2069 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8509 0.8385 2.2691 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0204 -0.3276 3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0125 -0.3850 4.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 0.7245 4.2395 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6547 1.8924 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6658 1.9508 2.5054 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9225 -1.0734 -3.7786 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5031 -1.6377 -4.6136 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2475 0.6692 -1.4987 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1651 -0.3615 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1788 -2.1134 0.9586 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4960 -1.3946 2.5625 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1609 -0.5401 2.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1693 -2.3187 2.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9837 0.6608 -3.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6534 -1.8860 -3.0821 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8347 -0.3365 -1.3638 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8685 0.3019 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4319 1.4428 -4.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3816 -1.1885 2.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1466 -1.2969 4.5764 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6041 0.6771 4.9988 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2876 2.7574 3.6742 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5259 2.8546 1.9134 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6509 0.8933 -0.5086 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9434 1.6297 -1.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0522 0.2546 -2.1141 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 2 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 18 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 8 27 1 0 27 28 3 0 7 29 1 0 10 6 1 0 20 16 2 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 8 35 1 6 9 36 1 6 11 37 1 0 14 38 1 0 14 39 1 0 22 40 1 0 23 41 1 0 24 42 1 0 25 43 1 0 26 44 1 0 29 45 1 0 29 46 1 0 29 47 1 0 M CHG 1 17 -1 M END