RDKit 3D 42 42 0 0 0 0 0 0 0 0999 V2000 4.2079 1.6540 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2949 0.9769 -0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0175 1.7394 -0.1603 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2141 -0.4563 -0.5209 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3791 -1.3297 0.3431 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0186 -0.8761 0.3466 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2513 -0.8277 -0.6674 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7391 -1.2395 -1.8958 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1295 -0.3500 -0.5700 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0987 -1.3283 -1.0223 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4691 -0.0315 0.8676 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8961 0.4456 0.8582 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1689 1.7683 0.6965 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4879 2.1789 0.6917 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5133 1.2711 0.8473 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2089 -0.0578 1.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8931 -0.4673 1.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3838 -2.7458 -0.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3394 -3.3596 -0.4616 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5997 -3.4299 -0.2531 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7301 2.5227 -0.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9013 0.8995 -1.6033 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5607 1.9891 -2.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8217 1.1149 0.8333 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 1.6811 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2815 2.8186 -0.0396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3335 1.5060 0.6536 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2682 -0.8606 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9498 -0.5478 -1.6011 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7395 -1.3905 1.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4547 -0.7793 -2.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2473 0.5472 -1.2081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0521 -2.2205 -0.5095 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1719 -1.4058 -2.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8135 0.7189 1.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4208 -0.9614 1.4659 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3488 2.4772 0.5743 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7421 3.2148 0.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5641 1.5581 0.8487 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0013 -0.7966 1.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7175 -1.5397 1.1463 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8795 -4.0803 0.4843 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 5 18 1 0 18 20 1 0 18 19 2 0 17 12 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 3 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 1 8 31 1 0 9 32 1 6 10 33 1 0 10 34 1 0 11 35 1 0 11 36 1 0 13 37 1 0 14 38 1 0 15 39 1 0 16 40 1 0 17 41 1 0 20 42 1 0 M END