RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 2.2779 2.0653 1.3833 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2069 1.0661 0.5291 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4538 0.6264 -0.1055 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4893 -0.3244 -0.9401 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6721 1.2298 0.1736 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8801 0.8017 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9288 0.3875 0.1956 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0248 -1.0987 0.3433 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1786 -1.6863 1.4248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1684 -2.0816 0.8381 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0010 -2.9430 -0.3698 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9318 -0.8366 0.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2388 -1.1110 0.2258 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1064 -0.0582 -0.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6665 1.2366 0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5943 2.3427 -0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3864 1.4611 0.3445 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5116 0.4823 0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1969 1.0209 0.9657 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4066 2.4552 1.8987 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2251 2.5196 1.5865 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8051 -0.2181 -0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1581 1.4789 -1.2747 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7049 0.8199 0.3061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7366 0.6520 -0.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0859 -1.4108 0.5729 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8226 -1.5859 -0.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6367 -2.6366 1.8087 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0496 -1.0253 2.2805 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6926 -2.6656 1.6249 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8419 -3.6759 -0.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9612 -2.3452 -1.3023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0494 -3.5273 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6352 -2.1161 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1361 -0.2471 -0.3337 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9788 3.1828 -0.6935 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2982 2.0449 -1.1292 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1726 2.6161 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1803 2.1046 0.6881 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 0.9994 2.0742 H 0 0 0 0 0 0 0 0 0 0 0 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 2 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 18 19 1 0 19 7 1 0 18 12 1 0 6 22 1 0 6 23 1 0 6 24 1 0 1 20 1 0 1 21 1 0 7 25 1 6 8 26 1 0 8 27 1 0 9 28 1 0 9 29 1 0 10 30 1 1 11 31 1 0 11 32 1 0 11 33 1 0 13 34 1 0 14 35 1 0 16 36 1 0 16 37 1 0 16 38 1 0 19 39 1 0 19 40 1 0 M END