RDKit 3D 31 32 0 0 0 0 0 0 0 0999 V2000 4.9288 1.0698 0.6833 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6305 0.7458 1.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 0.3845 0.2139 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8916 0.3544 -1.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2635 0.0552 0.6827 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9656 0.0877 1.9681 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3289 -0.2361 2.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 0.3037 1.5782 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6468 1.6077 2.0531 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0702 0.3798 0.1061 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2143 -0.3226 -0.2632 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1971 -1.7543 -0.1328 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5094 -1.8592 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0765 -0.5114 -0.5944 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3386 -0.3499 -0.0272 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1084 -0.2311 -2.0876 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0109 -1.1341 -2.6793 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6205 0.6540 1.4676 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2084 0.6576 -0.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0745 2.1752 0.7415 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7584 0.3677 2.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2948 -0.2797 1.8043 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8549 1.6136 3.0043 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1059 1.4172 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4545 -0.0642 -1.3132 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -2.6204 0.0831 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1246 -2.7615 -0.2963 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6604 0.5426 -0.3126 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1148 -0.4070 -2.5407 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3961 0.8053 -2.2761 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8219 -0.6900 -2.9991 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 1 14 16 1 0 16 17 1 0 11 5 1 0 14 10 1 0 1 18 1 0 1 19 1 0 1 20 1 0 6 21 1 0 8 22 1 6 9 23 1 0 10 24 1 6 11 25 1 6 12 26 1 0 13 27 1 0 15 28 1 0 16 29 1 0 16 30 1 0 17 31 1 0 M END