RDKit 3D 81 85 0 0 0 0 0 0 0 0999 V2000 -4.8459 0.8181 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7201 0.7735 1.7104 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9382 -0.5067 1.7108 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7926 -1.6821 1.4261 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9045 -2.9096 1.3392 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -1.5984 0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9967 -1.3856 -1.0702 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0239 -1.7687 -2.1459 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4179 -1.4329 -3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1166 -1.5534 -3.5792 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2262 -1.8170 -2.4459 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3678 -0.5900 -2.1981 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0523 -0.9776 -2.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9907 -0.2671 -2.6581 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9225 1.1771 -2.8606 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2089 1.5357 -4.0848 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5969 2.0358 -1.8763 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1925 2.6682 -0.8342 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0730 3.3252 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2779 2.1102 0.8732 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8946 1.4350 1.0913 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8586 1.8893 0.2350 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8212 0.8789 -0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2511 -0.1060 0.5485 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2393 -1.1292 0.0391 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1946 -1.4296 1.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6089 -1.0325 0.8714 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3774 -0.2247 1.9162 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4205 -2.1291 0.3654 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0742 -1.0598 -0.4531 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9766 -1.2683 -1.4858 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7159 -2.6392 -1.6395 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -0.5608 -1.0659 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0713 2.4611 2.0824 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4223 3.5116 2.7418 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4377 2.9260 1.7225 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4126 4.1288 1.0189 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2875 1.9692 0.9672 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8955 -2.2082 -1.2945 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4465 1.7357 2.4367 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1796 -0.0550 2.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5735 -0.6119 2.7773 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0234 -0.4245 1.1055 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4458 -1.8538 2.3227 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9695 -2.6765 0.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4756 -3.6496 0.7175 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7462 -3.3626 2.3455 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2882 -2.5126 0.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3992 -0.7520 0.3681 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -0.3084 -1.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9695 -1.2175 -1.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1383 -2.8705 -2.0792 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0363 -1.0980 -4.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6736 -1.4535 -4.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -2.6398 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7615 -0.1398 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5286 0.1211 -3.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -1.8293 -1.4114 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8626 -0.8277 -3.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9021 3.4716 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5467 4.1238 0.6013 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7543 3.6378 -0.6231 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8757 1.4619 0.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4614 2.6325 0.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2428 0.8719 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8699 -0.1505 1.5653 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7341 -2.0455 -0.2927 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1678 -2.5237 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9015 -0.9119 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8996 0.5989 1.4242 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1056 -0.8391 2.4618 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6126 0.1124 2.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 -0.4307 -0.7945 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2847 -0.8797 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8697 -2.9332 -2.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1437 1.5608 2.7163 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1483 3.2661 3.6509 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 3.1574 2.6849 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1819 4.7087 1.1989 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8837 1.6346 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2283 2.5348 0.6887 H 0 0 0 0 0 0 0 0 0 0 0 0 5 4 1 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 1 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 20 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 2 1 0 2 1 2 3 2 3 1 0 11 39 1 0 3 4 1 0 39 7 1 0 22 18 1 0 33 25 1 0 30 27 1 0 5 45 1 0 5 46 1 0 5 47 1 0 4 44 1 1 6 48 1 0 6 49 1 0 7 50 1 6 8 51 1 0 8 52 1 0 9 53 1 0 10 54 1 0 11 55 1 6 12 56 1 0 12 57 1 0 13 58 1 0 14 59 1 0 18 60 1 6 19 61 1 0 19 62 1 0 20 63 1 6 22 64 1 1 23 65 1 0 24 66 1 0 25 67 1 6 26 68 1 0 26 69 1 0 28 70 1 0 28 71 1 0 28 72 1 0 30 73 1 6 31 74 1 6 32 75 1 0 34 76 1 1 35 77 1 0 36 78 1 1 37 79 1 0 38 80 1 0 38 81 1 0 1 40 1 0 1 41 1 0 3 42 1 0 3 43 1 0 M END