RDKit 3D 39 40 0 0 0 0 0 0 0 0999 V2000 4.9472 0.9302 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 0.6860 0.4808 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5069 1.5174 1.0129 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1658 1.3519 0.6626 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8495 0.3365 -0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8528 -0.4702 -0.7692 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1981 -0.3198 -0.4577 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2512 -1.2155 -1.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.4015 -1.6278 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -1.2604 -1.6853 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8735 -1.9950 -2.2712 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4923 -0.0694 -0.7646 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4571 -0.5198 0.3132 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.9356 -0.1663 0.1359 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6708 -0.8077 1.3198 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4614 -0.7362 -1.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1116 1.3732 0.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1555 2.0893 0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3381 1.9102 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5138 1.3834 0.0907 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 1.6060 1.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4241 -0.0078 1.2117 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7727 2.3139 1.7092 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4149 2.0228 1.0719 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -1.6505 -1.9961 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4798 -2.0289 -0.3494 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1688 -0.6592 -1.2606 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7827 -2.1171 -2.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9315 0.7335 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3348 -1.5294 0.4583 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1508 -0.0480 1.1748 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7494 -0.6210 1.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -0.3986 2.2743 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -1.8934 1.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5452 -0.5966 -1.2656 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0149 -0.2389 -2.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2714 -1.8121 -1.2538 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1848 1.3905 -0.2079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4387 2.9186 0.0741 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 14 17 1 0 17 18 2 0 17 19 1 0 7 2 1 0 12 5 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 4 24 1 0 8 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 12 29 1 6 13 30 1 0 13 31 1 0 15 32 1 0 15 33 1 0 15 34 1 0 16 35 1 0 16 36 1 0 16 37 1 0 19 38 1 0 19 39 1 0 M CHG 1 13 1 M END