RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 0.1921 5.3037 -0.8462 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4956 4.0943 -1.4733 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8481 4.4812 -1.7675 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 3.6611 -2.7939 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1304 2.1592 -2.9469 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 1.7457 -1.6937 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5184 2.7986 -0.6146 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7835 2.5464 0.1119 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8648 2.2628 1.4229 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1557 1.9888 2.1489 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2787 0.5379 2.6377 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3169 -0.4561 1.5023 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5241 -0.4271 0.6123 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9356 -1.7984 1.8578 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9905 -1.0646 1.0694 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7443 -1.5595 -0.3212 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.3971 -1.3041 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8855 0.2382 -1.3176 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7540 -0.5590 -2.3126 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5145 0.1002 -0.0398 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0797 6.1849 -1.4884 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2703 5.5570 0.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 5.1405 -0.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2517 4.7909 -0.9379 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2372 4.2164 -3.6512 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2449 3.8107 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7121 1.9629 -3.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8163 1.6196 -3.0469 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9738 1.9654 -1.9093 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3353 2.8615 0.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6985 2.5933 -0.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0447 2.1948 2.0174 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2046 2.6587 3.0159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0137 2.2437 1.5155 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 0.4387 3.2278 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 0.3107 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6117 -1.3284 -0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4381 -0.3550 1.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 0.4358 -0.0592 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0815 -0.7529 1.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1188 -2.2343 -0.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5968 -2.1569 -0.6645 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2925 0.3597 -1.1063 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7651 -0.7580 -2.3152 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7868 -0.1917 -2.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8097 -1.6147 -2.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3639 -0.4998 -3.3337 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 0.4351 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 16 15 1 0 12 15 1 0 7 8 1 0 4 2 1 0 8 9 2 0 2 7 1 0 9 10 1 0 7 6 1 0 10 11 1 0 12 11 1 0 6 5 1 0 2 3 1 6 5 4 1 0 2 1 1 0 14 12 1 0 12 13 1 6 6 18 1 0 18 19 1 0 18 20 1 1 18 17 1 0 6 29 1 6 15 14 1 0 7 30 1 1 17 16 1 0 15 40 1 1 4 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 17 43 1 0 17 44 1 0 16 41 1 0 16 42 1 0 8 31 1 0 9 32 1 0 10 33 1 0 10 34 1 0 11 35 1 0 11 36 1 0 3 24 1 0 1 21 1 0 1 22 1 0 1 23 1 0 13 37 1 0 13 38 1 0 13 39 1 0 19 45 1 0 19 46 1 0 19 47 1 0 20 48 1 0 M END