RDKit 3D 48 48 0 0 0 0 0 0 0 0999 V2000 5.0579 4.2961 1.0331 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3266 4.6703 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5328 3.8077 -1.2059 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5041 3.9121 -2.3408 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6276 4.2729 -3.7584 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8985 3.3446 -4.6649 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3334 2.4052 -3.9039 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5832 1.2397 -3.7139 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9719 0.2939 -3.6225 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7629 0.1964 -2.0978 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1111 -0.8201 -1.4648 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5359 -1.6033 -0.7701 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0073 -1.5797 0.5704 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5679 -2.5650 1.1182 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1599 -2.1579 2.5882 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5715 -2.1193 1.9217 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7484 -1.7171 2.6633 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8185 -2.4283 1.8351 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8168 -3.2417 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5197 -2.4131 3.6016 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9215 -2.3179 4.7563 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7011 -1.7588 3.4345 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0079 -3.3439 1.0462 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8609 -3.4627 1.6199 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3442 4.5840 2.0087 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2044 3.4940 1.1442 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9693 5.3338 -0.5795 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9898 2.9888 -0.6178 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7326 2.5832 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1371 5.0142 -4.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9053 3.6782 -5.6209 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0951 2.7571 -2.7472 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6189 1.2231 -5.1784 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4403 -0.6269 -3.9938 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 1.0955 -1.7163 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8253 0.1948 -0.4277 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4961 -2.7196 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 -0.5823 1.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6806 -3.5733 0.9063 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7619 -1.2202 2.8578 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0516 -3.0618 3.1194 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 -1.4744 0.9602 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8022 -1.7725 3.7106 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8839 -0.5491 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2618 -1.7173 1.1111 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6224 -3.5739 1.8714 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2989 -4.1349 2.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7464 -0.7621 3.5947 H 0 0 0 0 0 0 0 0 0 0 0 0 22 20 1 0 20 21 2 0 20 19 1 0 19 18 1 0 18 17 1 0 17 16 1 0 16 15 1 0 15 14 1 0 14 13 2 0 13 12 1 0 12 11 2 0 11 10 1 0 10 9 2 0 9 8 1 0 8 7 2 0 7 6 1 0 6 5 2 0 5 4 1 0 4 3 2 0 3 2 1 0 2 1 2 0 16 24 1 0 24 23 1 0 23 18 1 0 22 48 1 0 19 46 1 0 19 47 1 0 18 45 1 6 17 43 1 0 17 44 1 0 16 42 1 6 15 40 1 0 15 41 1 0 14 39 1 0 13 38 1 0 12 37 1 0 11 36 1 0 10 35 1 0 9 34 1 0 8 33 1 0 7 32 1 0 6 31 1 0 5 30 1 0 4 29 1 0 3 28 1 0 2 27 1 0 1 25 1 0 1 26 1 0 M END