RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 -3.8035 -0.1936 3.2733 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4676 0.4232 1.8979 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7423 1.0996 1.3606 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3652 1.4789 2.1034 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9816 -0.6640 0.9509 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7466 -1.9147 1.3012 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2894 -2.6807 0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1936 -1.9904 -0.8631 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6474 -0.3588 -0.7144 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7226 -2.5495 -2.0249 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5715 -1.9215 -3.2445 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9546 -0.7901 -3.5253 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8442 -2.7970 -4.2634 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4266 -1.8795 -5.1805 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2297 -1.0466 -3.8582 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 0.1106 -4.1218 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3438 0.8767 -3.1687 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8958 1.9438 -3.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2835 0.3372 -1.8069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6766 0.8488 -0.6313 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3615 2.1692 -0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6871 2.4095 1.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3937 1.2151 1.7006 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7616 -0.1489 1.3693 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4615 -0.0104 0.5825 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8567 -1.6064 -0.0588 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7502 -1.0020 -1.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2661 -1.6894 -2.6507 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1548 0.5703 3.9764 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5899 -0.9533 3.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9264 -0.6751 3.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5318 0.3634 1.1693 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1333 1.8293 2.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5586 1.6379 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6749 2.2368 2.8326 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 1.0205 2.4706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 2.0032 1.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4103 -3.5032 -1.9002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5867 -3.1817 -4.9696 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3693 -3.6560 -3.7792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7271 2.9858 -0.7894 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2968 2.1855 -0.9995 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7579 2.6159 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3087 3.3059 1.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4452 1.2026 1.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4061 1.3583 2.7885 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5861 -0.7030 2.3001 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4972 -0.7340 0.7994 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6752 0.4218 1.2125 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 2 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 9 5 1 0 28 15 1 0 27 19 1 0 25 20 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 4 37 1 0 10 38 1 0 13 39 1 0 13 40 1 0 21 41 1 0 21 42 1 0 22 43 1 0 22 44 1 0 23 45 1 0 23 46 1 0 24 47 1 0 24 48 1 0 25 49 1 1 M END