RDKit 3D 57 59 0 0 0 0 0 0 0 0999 V2000 -1.1886 3.1041 -3.4447 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6251 2.2780 -2.2706 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7426 2.8636 -1.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1851 2.1123 0.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5033 0.7643 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4198 0.1755 -1.3557 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9817 0.9340 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0369 -0.2206 1.2896 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0696 -1.1181 0.8158 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2828 0.6695 2.4082 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6251 -1.1181 1.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4305 -0.3369 2.1019 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7181 -0.5287 1.0968 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8003 0.5502 1.2853 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 0.7893 0.0545 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 1.9266 -0.7022 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 2.9197 -0.4389 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3206 1.7466 -1.9586 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8449 0.4240 -1.7054 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3284 -0.1301 -0.5609 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5272 -1.2773 -0.1965 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4315 2.7853 -2.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 1.7651 -3.2088 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2836 -1.8313 1.3119 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8637 -2.3652 2.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3691 -2.3338 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5681 -3.5154 4.3658 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2544 -4.7464 3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7416 -4.7997 2.4984 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5471 -3.6107 1.7731 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -3.7289 0.4188 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.1864 -4.6304 0.2132 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4541 -2.9728 -0.4600 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.7088 2.4803 -4.2059 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 3.6042 -3.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4592 3.8613 -3.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4868 3.9118 -0.8578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2739 2.5853 1.0625 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6898 -0.8690 -1.5003 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9236 0.4682 -3.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.6615 3.1023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6854 0.7241 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3276 -0.5030 0.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3569 1.5003 1.6004 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 0.2298 2.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3993 -0.1295 -2.3464 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0143 2.7856 -1.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1252 2.5861 -2.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0252 3.7944 -2.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0334 1.4984 -4.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6225 1.0512 -3.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0145 2.7565 -3.3713 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0579 -1.9301 0.7138 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6157 -1.3855 4.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9684 -3.4717 5.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4091 -5.6641 4.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4989 -5.7669 2.0619 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 1 0 13 14 1 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 18 22 1 0 18 23 1 0 13 24 1 0 11 25 1 0 25 26 2 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 31 33 1 0 7 2 1 0 20 15 1 0 30 25 1 0 1 34 1 0 1 35 1 0 1 36 1 0 3 37 1 0 4 38 1 0 6 39 1 0 7 40 1 0 12 41 1 0 12 42 1 0 13 43 1 6 14 44 1 0 14 45 1 0 19 46 1 0 22 47 1 0 22 48 1 0 22 49 1 0 23 50 1 0 23 51 1 0 23 52 1 0 24 53 1 0 26 54 1 0 27 55 1 0 28 56 1 0 29 57 1 0 M CHG 2 31 1 33 -1 M END