RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 7.8429 1.9997 0.1528 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3243 1.0101 1.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9233 0.5512 0.8674 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7097 -0.5676 0.0516 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4117 -0.9855 -0.2579 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3105 -0.2858 0.2496 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5201 0.8453 1.0464 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 1.2594 1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9132 -0.6963 -0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6897 -2.0354 -0.2595 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4546 -2.5389 -0.5401 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2686 -3.7328 -0.7454 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6365 -1.5493 -0.5944 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3112 -0.2661 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 0.1805 -0.1015 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3711 0.8008 -0.4395 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6302 0.3199 -1.1572 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0647 -1.0283 -0.7065 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0077 -2.0685 -0.8814 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9433 -1.1466 0.7439 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3977 -2.5121 0.8931 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -0.4924 1.7845 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3879 -0.1645 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2971 -0.6070 -0.5591 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4352 0.1536 -0.8268 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6524 1.3356 -0.1237 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7548 1.7733 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6134 1.0192 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7455 2.0642 -0.3843 F 0 0 0 0 0 0 0 0 0 0 0 0 7.8669 1.5545 -0.8477 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 2.8938 0.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8596 2.3147 0.4082 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9935 0.1426 1.2359 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3454 1.4681 2.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5570 -1.1155 -0.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2871 -1.8372 -0.9196 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6732 1.4076 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9595 2.1410 1.9768 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4249 -2.7192 -0.1697 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9843 1.6778 -0.9731 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6081 1.1319 0.5775 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4425 0.2617 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4346 1.0520 -1.0411 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2202 -2.9425 -0.2568 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0586 -2.4130 -1.9217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1226 -1.5365 -1.0971 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1557 -0.1677 -1.5728 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9541 2.6954 1.3848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9152 1.3547 1.8858 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 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 2 0 20 22 2 0 20 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 26 29 1 0 8 3 1 0 15 9 2 0 19 13 1 0 28 23 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 4 35 1 0 5 36 1 0 7 37 1 0 8 38 1 0 10 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 17 43 1 0 19 44 1 0 19 45 1 0 24 46 1 0 25 47 1 0 27 48 1 0 28 49 1 0 M END