RDKit 3D 58 61 0 0 0 0 0 0 0 0999 V2000 -2.9962 3.9334 -0.2593 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 2.6530 0.2718 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0769 1.4446 -0.3021 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4307 0.6655 -1.2871 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0568 -0.4575 -1.8404 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3379 -0.8090 -1.4164 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0104 -0.0331 -0.4648 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3817 1.0894 0.0897 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1662 -2.1854 -2.1949 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8587 -2.1275 -3.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5255 -2.2240 -1.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3797 -3.5098 -1.5181 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2921 2.7192 1.8105 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.1735 3.6381 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2136 1.3656 2.5518 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2506 0.3505 1.9363 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7964 -0.8770 1.5982 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1336 -1.7945 0.8061 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -2.6997 0.2708 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2465 -1.4558 0.6403 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7613 -0.2761 1.1041 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0155 0.7039 1.7382 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1335 -0.1235 0.8295 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6356 -1.2095 0.1268 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4084 -2.3929 -0.1537 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -1.4088 -0.3517 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2721 -1.7270 -1.6861 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5920 -1.8069 -2.1466 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6703 -1.5864 -1.2808 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4203 -1.3070 0.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -1.2162 0.5229 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9040 -1.6505 -1.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0344 -1.5192 -1.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0072 4.0647 0.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0713 3.9053 -1.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4178 4.8220 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3041 2.6159 -0.0558 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4366 0.9373 -1.6526 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5575 -1.0413 -2.6141 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0401 -0.2721 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9433 1.6956 0.8011 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0274 -4.0606 -0.9499 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4739 -3.3275 -1.0701 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1625 3.1614 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3838 4.6475 1.9047 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2216 3.2709 1.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1724 3.6504 3.3715 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 1.5791 3.5815 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2353 0.9746 2.5959 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7878 -1.0588 1.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 0.7380 1.1003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4576 -1.8786 -2.3964 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7796 -2.0146 -3.1972 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2262 -1.1338 0.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9331 -0.9811 1.5706 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0587 -0.5241 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0517 -2.3071 -0.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9362 -1.6292 -1.6313 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 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 6 9 1 0 9 10 2 0 9 11 2 0 9 12 1 0 2 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 2 0 24 25 1 0 24 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 29 32 1 0 32 33 1 0 8 3 1 0 22 16 2 0 25 20 1 0 31 26 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 6 4 38 1 0 5 39 1 0 7 40 1 0 8 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 14 45 1 0 14 46 1 0 14 47 1 0 15 48 1 0 15 49 1 0 17 50 1 0 23 51 1 0 27 52 1 0 28 53 1 0 30 54 1 0 31 55 1 0 33 56 1 0 33 57 1 0 33 58 1 0 M CHG 1 13 1 M END