RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 3.4894 1.3406 1.5672 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2158 1.1454 0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0482 0.3290 -0.1280 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5128 -0.4463 -1.3673 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9577 1.3066 -0.5154 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3451 0.5954 -0.7668 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4464 1.6289 -0.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6738 1.1048 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8944 1.9652 -0.8601 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7323 -0.3819 -0.8762 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8776 -1.0427 0.1794 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6403 -0.2553 0.4348 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5074 -1.1350 0.8526 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1976 -1.5598 2.2999 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6142 -2.4104 0.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7113 -0.4824 0.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3562 1.9467 1.8857 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8469 0.8945 2.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8541 1.5886 -0.4526 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6796 -0.5743 -2.0947 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0228 -1.3792 -1.1063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2778 0.1672 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8457 2.1105 0.2121 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2731 1.7579 -1.4948 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3369 -0.0175 -1.6667 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2937 2.6794 -0.7529 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9257 2.5305 -1.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 2.6851 0.0035 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7658 1.3158 -0.7264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7832 -0.7301 -0.8366 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3541 -0.6727 -1.8988 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6404 -2.0796 -0.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4802 -1.1887 1.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8577 0.3984 1.3321 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.6289 2.8718 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6241 -2.2812 2.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1572 -1.9775 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -3.1539 0.5248 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3929 -2.2854 -1.0142 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6491 -2.8076 0.2433 H 0 0 0 0 0 0 0 0 0 0 0 0 9 8 1 0 8 7 2 0 7 6 1 0 6 5 1 0 5 3 1 0 3 4 1 6 3 16 1 0 16 13 1 0 13 14 1 1 13 15 1 0 13 12 1 0 12 11 1 0 11 10 1 0 3 2 1 0 2 1 2 3 10 8 1 0 12 6 1 0 9 27 1 0 9 28 1 0 9 29 1 0 7 26 1 0 6 25 1 6 5 23 1 0 5 24 1 0 4 20 1 0 4 21 1 0 4 22 1 0 14 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 15 40 1 0 12 34 1 1 11 32 1 0 11 33 1 0 10 30 1 0 10 31 1 0 2 19 1 0 1 17 1 0 1 18 1 0 M END