RDKit 3D 115121 0 0 0 0 0 0 0 0999 V2000 5.8051 -1.8494 0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8961 -0.8301 0.8008 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2674 0.0664 1.6044 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5645 -0.8364 0.4244 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6787 0.1792 0.9682 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2793 -0.1069 0.3592 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9734 -1.4816 0.8016 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1782 -2.4349 -0.2522 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0042 -3.5255 -0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2439 -4.5271 -1.2302 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6429 -3.7101 0.9113 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3319 -1.7611 1.4893 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9163 -2.8658 0.8303 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2583 -4.0413 1.4463 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0487 -4.1415 2.6888 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8447 -5.1941 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -5.2551 -0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6156 -6.4853 -0.8442 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7021 -7.1254 0.2877 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2609 -6.4067 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2676 -0.5857 1.5550 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4590 -0.7797 2.1662 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7662 -0.8127 1.7874 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 -1.9715 1.8396 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6452 0.2601 1.3221 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.1888 1.6629 1.6321 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1912 0.2168 -0.0379 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4782 1.6129 -0.5304 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5531 -0.6650 -1.0386 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7695 -1.9956 -0.7932 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3638 -2.9882 -1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6762 -2.7158 -2.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4394 -1.3907 -3.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8733 -0.3501 -2.1801 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5087 1.0088 -2.6511 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0696 1.2735 -3.8049 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6869 1.9171 -1.9942 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2826 2.0490 -2.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7055 2.2935 -0.7183 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3156 3.5806 -0.2802 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7668 1.2020 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3584 0.9767 0.8587 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9086 2.3161 0.8141 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0419 2.7335 1.3886 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1306 3.7579 2.2798 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0854 4.4076 2.6345 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3882 4.1832 2.8838 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4587 5.2207 3.7851 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6477 5.6352 4.3672 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 4.9890 4.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7808 3.9367 3.1296 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5814 3.5525 2.5719 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7997 2.5170 -0.7195 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5898 1.5454 -1.4870 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2880 1.6523 -2.8531 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 2.1473 -3.8224 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6076 2.1734 -5.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2541 2.5369 -3.4907 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5006 0.0833 -1.1262 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9555 -0.7569 -2.0237 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3167 -1.6623 -2.9079 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4402 -2.4411 -3.7727 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5519 -1.7942 -2.9345 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3877 0.5529 2.0996 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3837 0.2058 3.2857 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1573 1.6437 2.5419 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2501 -2.6429 -0.2422 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5332 -1.3784 -0.4427 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3902 -2.3097 1.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7541 0.1062 2.0157 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 1.0841 0.4689 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -1.8974 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6103 -4.4607 -2.1098 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3236 -4.5620 -1.4395 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9895 -5.5228 -0.7554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2355 -2.0939 2.5556 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8835 -4.4936 -1.3195 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9083 -6.8407 -1.8235 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2123 -6.6802 2.3236 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4918 -0.4209 0.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5606 0.1771 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8755 1.6370 2.7227 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0549 2.3500 1.6281 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3618 2.0041 1.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2859 -0.1918 0.1067 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7267 2.3621 -0.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4141 1.9819 -0.0378 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7057 1.4981 -1.6293 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5641 -4.0342 -1.3527 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3405 -3.5099 -3.4174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9171 -1.1395 -3.9821 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8914 1.0580 -2.3943 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9905 2.8560 -2.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 4.4509 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1823 3.9239 -0.9293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7095 3.6494 0.7232 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0861 2.9939 1.2343 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5571 5.7296 4.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6765 6.4629 5.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7558 5.3184 4.4982 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6767 3.4192 2.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5433 2.7343 1.8644 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0606 3.5250 -1.0153 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6528 1.9505 -1.4075 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 1.2190 -5.7416 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0526 3.0416 -5.7559 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4992 2.3307 -5.2053 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5931 -0.2421 -1.3004 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1372 -3.1632 -3.1338 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0693 -3.0711 -4.4504 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2908 -1.8170 -4.3342 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0003 1.1166 3.5609 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9164 -0.7130 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3482 0.1860 4.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5421 1.4167 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 28 27 1 0 27 25 1 0 25 26 1 0 25 23 1 0 23 24 2 0 23 22 1 0 22 21 1 0 21 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 20 2 0 20 19 1 0 19 18 1 0 18 17 2 0 12 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 7 6 1 0 6 5 1 1 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 6 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 61 63 2 0 59 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 56 58 2 0 54 53 1 0 53 43 1 0 43 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 47 48 2 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 2 0 43 42 1 0 42 41 1 6 41 39 1 0 39 40 1 1 39 38 1 0 38 37 1 0 37 35 1 0 35 36 2 0 35 34 1 0 34 33 2 0 33 32 1 0 32 31 2 0 31 30 1 0 30 29 2 0 42 64 1 0 64 65 1 0 64 66 1 1 29 27 1 0 64 21 1 0 17 16 1 0 42 6 1 0 29 34 1 0 39 53 1 0 52 47 1 0 28 86 1 0 28 87 1 0 28 88 1 0 27 85 1 1 25 81 1 1 26 82 1 0 26 83 1 0 26 84 1 0 21 80 1 6 12 76 1 1 20 79 1 0 18 78 1 0 17 77 1 0 7 72 1 1 10 73 1 0 10 74 1 0 10 75 1 0 5 70 1 0 5 71 1 0 1 67 1 0 1 68 1 0 1 69 1 0 59108 1 1 62109 1 0 62110 1 0 62111 1 0 54104 1 6 57105 1 0 57106 1 0 57107 1 0 53103 1 1 43 97 1 1 48 98 1 0 49 99 1 0 50100 1 0 51101 1 0 52102 1 0 40 94 1 0 40 95 1 0 40 96 1 0 38 92 1 0 38 93 1 0 33 91 1 0 32 90 1 0 31 89 1 0 65112 1 0 65113 1 0 65114 1 0 66115 1 0 M END