RDKit 3D 31 31 0 0 0 0 0 0 0 0999 V2000 4.9205 -0.7122 -0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1414 0.4212 0.3445 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6849 0.1895 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1963 -0.9197 -0.4425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8123 -1.0974 -0.5725 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0241 -0.1052 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4233 -0.2222 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0373 -1.4000 -0.8145 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2062 0.7102 0.3652 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6773 0.6104 0.2765 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0965 1.0292 -1.1136 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2439 1.4975 1.2125 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5331 0.9450 0.5523 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8156 1.1426 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2511 2.1788 1.2749 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7993 -1.6600 0.2842 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0013 -0.4639 -0.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6412 -0.7902 -1.3421 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4686 1.3593 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4347 0.5593 1.3997 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8484 -1.6749 -0.8459 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4049 -1.9627 -1.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4657 -1.6039 -1.7586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9345 -2.3070 -0.1953 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0773 -1.2497 -1.1187 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7732 1.5675 0.8537 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9834 -0.4351 0.4953 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 0.3223 -1.5361 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2173 1.0504 -1.7653 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 2.0440 -1.0528 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4317 0.9771 2.0119 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 1 0 7 9 2 0 9 10 1 0 10 11 1 0 10 12 1 0 6 13 1 0 13 14 1 0 14 15 2 0 14 3 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 4 21 1 0 5 22 1 0 8 23 1 0 8 24 1 0 8 25 1 0 9 26 1 0 10 27 1 1 11 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 M END