RDKit 3D 77 81 0 0 0 0 0 0 0 0999 V2000 4.7198 -1.1558 3.3387 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8455 -0.7076 2.2218 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3241 -0.4071 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4643 0.0051 -0.0233 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0244 0.3282 -1.3808 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2633 -0.9767 -2.1242 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6203 -1.4889 -1.8589 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8129 -2.6728 -1.5697 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7492 -0.5689 -1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0095 -0.9806 -2.3094 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2755 -2.2790 -2.6235 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0268 -0.0120 -2.3545 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7447 1.2906 -2.0389 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7578 2.2760 -2.0801 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4928 1.6999 -1.6746 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4611 0.7573 -1.6209 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1853 1.0897 -1.2645 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1328 0.1050 0.2579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -0.1894 1.5115 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2531 -0.0449 1.6416 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6261 -0.2250 2.6870 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5689 -1.1987 2.2611 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9151 -0.8671 0.9557 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5616 -2.0999 0.3395 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9086 0.2717 1.0585 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5104 0.6034 -0.1247 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9057 0.5283 -0.0760 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3481 -0.4975 -0.8983 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7344 -0.4410 -0.9004 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.3558 -1.7693 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9185 -2.7001 -0.3201 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1163 0.6474 -1.8812 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.6296 0.2314 -3.1445 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4782 1.9204 -1.4633 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8931 2.4959 -2.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4764 1.8540 -0.3775 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0792 2.3553 0.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1175 1.4670 1.5646 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9836 2.5224 1.8893 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4704 1.0482 2.8657 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4712 0.6874 3.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4714 -0.5946 2.4783 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9894 -0.9002 3.7408 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7831 -1.0156 3.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5476 -0.4984 4.2122 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4858 -2.1921 3.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3752 -0.4889 0.7629 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2734 0.8974 -1.9515 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5297 -1.7108 -1.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0616 -0.8412 -3.2163 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6335 -3.0089 -2.6374 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0213 -0.3251 -2.6418 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8513 2.7342 -2.9784 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2426 2.7314 -1.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4594 0.4265 -0.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2091 -0.5215 3.6581 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0531 -0.5918 0.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8963 -1.9124 -0.6831 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7419 -2.8636 0.2607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3215 -2.5376 1.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -0.0023 1.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1469 0.2002 0.9768 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0577 -0.1096 0.1019 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0898 -2.0946 -2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4472 -1.6862 -1.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0430 -2.3150 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2183 0.7638 -1.9507 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8864 -0.4118 -3.0364 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2985 2.6516 -1.1987 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2711 1.8587 -3.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6655 2.6050 -0.6083 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1866 3.3427 0.6406 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3412 1.7883 0.8681 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4648 2.3392 2.7334 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8537 1.8350 3.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1488 0.7486 4.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5484 -1.2026 4.5071 H 0 0 0 0 0 0 0 0 0 0 0 0 24 23 1 0 23 22 1 0 22 21 1 0 21 20 1 0 20 19 1 0 19 18 2 0 18 4 1 0 4 3 2 0 3 2 1 0 2 1 1 0 2 42 2 0 42 43 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 16 2 0 16 17 1 0 16 15 1 0 15 13 2 0 13 14 1 0 13 12 1 0 12 10 2 0 10 11 1 0 21 40 1 0 40 41 1 0 40 38 1 0 38 39 1 0 38 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 29 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 25 23 1 0 36 27 1 0 42 19 1 0 17 5 1 0 10 9 1 0 24 58 1 0 24 59 1 0 24 60 1 0 23 57 1 6 21 56 1 1 18 55 1 0 3 47 1 0 1 44 1 0 1 45 1 0 1 46 1 0 43 77 1 0 5 48 1 6 6 49 1 0 6 50 1 0 15 54 1 0 14 53 1 0 12 52 1 0 11 51 1 0 40 75 1 1 41 76 1 0 38 73 1 6 39 74 1 0 25 61 1 1 27 62 1 1 29 63 1 1 30 64 1 0 30 65 1 0 31 66 1 0 32 67 1 6 33 68 1 0 34 69 1 1 35 70 1 0 36 71 1 6 37 72 1 0 M END