RDKit 3D 81 86 0 0 0 0 0 0 0 0999 V2000 3.2177 3.1933 1.1509 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7368 3.2290 0.9987 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0562 2.3363 0.0431 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0780 0.8865 0.1560 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7570 0.2834 1.3341 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7058 -0.8296 1.0984 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2884 -1.2595 2.4623 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7668 -0.7320 0.1218 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1387 0.2697 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2012 -0.0926 -1.4521 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5039 -1.3477 -1.1081 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5128 -2.2031 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6636 -3.4829 -1.0967 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7945 -3.9098 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8051 -3.0774 0.3445 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6597 -1.7831 -0.1533 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6255 -0.4066 2.0413 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0797 -0.9779 0.9735 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4884 -2.1867 0.8522 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2505 0.1538 -0.0059 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3886 -0.4634 -1.3484 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1936 -1.6311 -1.3443 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9871 -0.0441 -2.5623 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2553 -0.0875 -2.8807 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3954 -0.5353 -2.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 0.1431 -2.3371 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6028 -1.6778 -1.2782 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4816 -2.8102 -2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8736 -1.8014 -0.6244 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8211 -2.9143 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3037 -1.0487 0.3521 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5211 0.0606 0.9138 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5550 0.7771 1.8713 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4544 -0.3983 1.8193 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5881 0.5345 2.4954 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6343 1.1751 1.8523 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4495 0.9419 0.4314 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4443 2.3454 -0.2140 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9055 2.4774 -1.4849 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2734 3.0125 -0.2508 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2506 4.5218 -0.3851 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7437 3.6515 0.2676 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5013 3.8902 2.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6427 2.2238 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2143 3.2983 1.9941 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5582 4.2898 0.5976 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6206 2.5760 -0.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6536 0.4409 -0.7302 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1114 0.9544 2.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1067 -1.7885 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3787 -1.3538 2.3188 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0376 -0.4746 3.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8706 -2.2189 2.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7348 1.2864 -0.8329 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7097 0.4892 -2.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1882 -1.8535 -2.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4496 -4.1433 -1.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8885 -4.8976 0.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1061 -3.3829 1.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4483 -0.4448 3.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2699 0.3635 -3.3804 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4817 0.3240 -3.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6822 -1.7785 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4367 -3.5759 -1.5215 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6239 -3.1142 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8663 -2.5830 -0.9677 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6654 -3.7925 -0.4424 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3239 -1.2907 0.7593 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3565 0.8922 0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8618 0.0793 2.6507 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3581 1.1365 1.2201 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9915 1.6497 2.2491 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -1.3658 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0656 -0.8752 2.6939 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6638 0.7741 3.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9547 1.8943 2.3484 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2598 0.4561 -0.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4294 2.8363 -0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3075 5.0416 0.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1995 4.8563 -0.9073 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 4.8890 -1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 17 1 0 17 18 1 0 18 19 2 0 20 18 1 1 20 37 1 0 37 36 1 0 36 35 2 0 35 34 1 0 34 32 1 0 32 33 1 0 32 31 1 0 31 29 2 0 29 30 1 0 29 27 1 0 27 28 1 0 27 25 1 0 25 26 2 0 25 24 1 0 24 23 2 0 23 21 1 0 21 22 2 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 6 5 6 1 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 40 3 1 0 16 8 1 0 20 4 1 0 21 20 1 0 40 38 1 0 16 11 1 0 1 42 1 0 1 43 1 0 1 44 1 0 2 45 1 0 2 46 1 0 3 47 1 6 4 48 1 6 5 49 1 1 17 60 1 0 37 77 1 6 36 76 1 0 35 75 1 0 34 73 1 0 34 74 1 0 32 69 1 6 33 70 1 0 33 71 1 0 33 72 1 0 31 68 1 0 30 65 1 0 30 66 1 0 30 67 1 0 27 63 1 1 28 64 1 0 24 62 1 0 23 61 1 0 38 78 1 6 41 79 1 0 41 80 1 0 41 81 1 0 6 50 1 6 7 51 1 0 7 52 1 0 7 53 1 0 9 54 1 0 10 55 1 0 12 56 1 0 13 57 1 0 14 58 1 0 15 59 1 0 M END