RDKit 3D 54 58 0 0 0 0 0 0 0 0999 V2000 4.6861 2.5407 0.8033 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1721 1.2805 1.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9621 0.1298 0.9767 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2772 0.2646 0.5114 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7778 1.5246 0.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9939 2.6626 0.3384 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0343 1.6393 -0.2499 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3993 -1.2351 1.2918 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9927 -2.0225 0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8553 -1.4356 -0.6666 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -0.5858 -1.7401 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1525 0.0141 -2.4266 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8884 -0.2616 -2.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -1.0660 -0.9742 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5713 -1.6830 -0.1877 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3213 -2.3326 0.8234 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9067 -1.1571 -0.8284 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5458 -0.3968 -1.7895 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4658 0.4005 -2.8305 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -0.2839 -1.9367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7086 -0.5626 -0.5676 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1766 -1.9166 -0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6562 -1.9348 0.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4452 0.5816 0.4480 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.8342 1.9869 -0.0207 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3427 2.1480 -0.2019 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2585 1.8989 1.3526 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.5213 0.3246 1.8956 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9934 0.3489 1.8569 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0694 3.4284 0.9199 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1499 1.2052 1.4857 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9268 -0.5978 0.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4085 3.6342 0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5461 -1.1346 1.9739 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1586 -1.8046 1.8427 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8388 -2.1014 -0.6559 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7197 -3.0419 0.3353 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1343 -0.4348 -1.9971 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -1.0458 -2.6548 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3328 0.6785 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7926 -0.6195 -0.7054 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7067 -2.2322 0.8731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4104 -2.6862 -0.7807 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4415 -1.4977 1.1969 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -2.9737 0.2366 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4213 0.6284 0.5561 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4457 2.6852 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2925 2.1952 -0.9459 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5576 3.1626 -0.5526 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7317 1.4596 -0.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8527 0.1420 2.9229 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9247 -0.4861 1.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5703 -0.5862 2.2312 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5897 1.1511 2.4867 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 0 3 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 14 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 21 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 6 1 1 0 15 10 1 0 19 13 1 0 23 17 1 0 29 24 1 0 1 30 1 0 2 31 1 0 4 32 1 0 6 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 11 38 1 0 20 39 1 0 20 40 1 0 21 41 1 6 22 42 1 0 22 43 1 0 23 44 1 0 23 45 1 0 24 46 1 0 25 47 1 0 25 48 1 0 26 49 1 0 26 50 1 0 28 51 1 0 28 52 1 0 29 53 1 0 29 54 1 0 M CHG 1 24 1 M END