RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 -3.6939 -2.3048 0.6778 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7488 -1.8009 1.7575 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8069 -0.2835 1.9641 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2256 0.4427 0.8279 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8621 0.6138 0.6655 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 1.2546 -0.3553 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1461 1.8459 -1.3905 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6987 2.3798 -2.3994 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6097 1.7311 -1.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 1.0271 -0.0973 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4608 0.9003 0.0769 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3023 1.4698 -0.8212 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8532 2.1859 -1.9232 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4835 2.3148 -2.1151 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7731 1.3165 -0.5725 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1976 1.3982 -0.3485 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6993 2.4888 -0.1135 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 0.1905 -0.5638 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2142 -0.0838 -0.4761 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1816 0.8642 -0.1436 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5277 0.4924 -0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9271 -0.8278 -0.2718 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -1.7756 -0.6027 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6121 -1.4063 -0.7068 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3738 -1.2347 -0.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6648 -1.9125 1.1977 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3847 -3.1471 1.2546 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 -1.1709 2.0767 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.6645 -3.3973 0.6305 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7251 -2.0049 0.8858 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4125 -1.9272 -0.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7267 -2.1144 1.5164 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0154 -2.2890 2.7019 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2248 -0.0403 2.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8303 0.0314 2.2011 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2667 0.1870 1.4715 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5497 2.6367 -2.6219 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0977 2.8641 -2.9707 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9567 0.6431 0.2709 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2152 2.2884 -0.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2685 0.9003 -1.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2527 -0.6069 -0.7846 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9253 1.8982 0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2675 1.2351 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 -2.8149 -0.7472 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8895 -2.1792 -0.9501 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6375 -1.9189 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0254 -0.3600 -0.2673 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 12 15 1 0 6 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 22 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 10 4 1 0 14 9 1 0 24 19 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 5 36 1 0 13 37 1 0 14 38 1 0 15 39 1 0 15 40 1 0 15 41 1 0 18 42 1 0 20 43 1 0 21 44 1 0 23 45 1 0 24 46 1 0 25 47 1 0 25 48 1 0 M CHG 1 28 -1 M END