RDKit 3D 104110 0 0 0 0 0 0 0 0999 V2000 7.7368 -1.7697 2.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5437 -1.8113 0.8587 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 -1.0536 0.3970 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9222 -0.0059 -0.5999 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9487 0.6096 -1.1525 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5942 0.3700 -0.8899 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7378 1.4784 -0.9874 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8299 2.1707 -2.0752 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 1.9761 -0.0181 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4037 2.7145 1.1346 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3183 3.7986 0.6065 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6957 4.6227 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 4.3219 -0.8670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9018 3.0269 -0.6291 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5719 2.8421 -1.0349 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1432 3.3834 -2.1146 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4857 2.0377 -0.3195 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2738 3.1097 0.4582 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2808 3.7959 1.4068 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8169 4.1794 -0.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1823 1.3195 -1.2273 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7993 0.6836 -2.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2125 0.2391 -3.2426 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1934 0.2920 -1.8786 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0089 1.3300 -1.0744 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3335 0.6280 -0.8864 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2715 1.1228 -1.7979 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8199 0.6853 0.4907 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 1.7247 1.3483 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5625 1.4852 2.6359 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7523 0.2012 3.0816 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3378 -0.1298 4.7046 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.4768 -0.8545 2.2334 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0167 -0.5891 0.9572 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6651 -1.4710 -0.0884 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0017 -0.8110 -1.1478 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5131 -0.8776 -1.0899 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6632 -1.7937 -0.4575 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6775 -1.7841 0.8104 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7394 -2.7863 -1.0563 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6441 -3.9568 -1.5207 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3642 -5.2235 -0.7532 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4216 -4.8640 0.7246 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -3.9470 1.0332 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -3.3782 -0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5867 -3.5095 -0.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1329 -4.6617 -0.0254 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5763 -2.4704 -0.6179 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9183 -1.2896 -1.3126 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1439 -1.8987 0.6046 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4196 -2.1079 1.8532 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3522 -1.1658 0.5866 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7078 -0.6125 1.6578 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -0.9938 -0.5797 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4580 -1.8581 -0.3424 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6152 -2.4406 2.4469 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0633 -0.7613 2.5928 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8968 -2.1669 2.8158 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9973 -0.5237 1.2196 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9643 0.1891 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0947 1.2123 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6084 3.2262 1.6901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9787 2.0934 1.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2264 3.2568 0.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7039 4.3814 1.4661 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4395 4.7247 -1.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6782 5.6854 -0.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0741 4.7151 -1.7541 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0469 1.4876 0.5022 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 2.6580 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2712 3.0683 1.9993 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 4.3465 2.1547 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3075 4.5748 0.9298 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0885 3.7194 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1367 5.0452 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7839 4.5810 -0.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6892 0.2541 -4.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6811 0.2160 -2.8908 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1522 2.1899 -1.7181 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5638 1.4759 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9744 0.8602 -2.6972 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9599 2.7414 1.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7855 2.3032 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6224 -1.8767 2.5731 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8785 -2.5126 -0.0747 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3543 -1.0864 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3028 -2.4432 -2.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5223 -4.1893 -2.5777 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7142 -3.7224 -1.3682 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4351 -5.7091 -1.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2393 -5.8890 -0.9309 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3913 -5.7681 1.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4097 -4.4015 0.8933 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4189 -3.3724 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3236 -2.9281 -1.2742 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6369 -0.4379 -1.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7774 -1.4295 -2.3783 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0594 -1.0137 -0.7037 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4045 -3.1647 2.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9571 -1.5546 2.6484 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4017 -1.6651 1.8077 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7304 -1.4902 -1.4566 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9167 -2.1507 -1.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1754 -2.7819 0.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 55 1 0 55 54 1 0 54 6 1 0 6 5 1 0 5 4 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 21 1 0 21 22 2 3 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 6 26 36 1 0 36 35 1 0 35 34 1 0 34 33 2 0 33 31 1 0 31 32 1 0 31 30 2 0 30 29 1 0 29 28 2 0 36 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 2 0 46 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 50 52 1 0 52 53 2 0 17 18 1 0 18 19 1 0 18 20 1 0 4 3 1 0 14 9 1 0 37 24 1 0 45 40 1 0 52 54 1 0 28 26 1 0 28 34 1 0 1 56 1 0 1 57 1 0 1 58 1 0 3 59 1 1 55103 1 0 55104 1 0 54102 1 6 4 60 1 0 9 61 1 1 10 62 1 0 10 63 1 0 11 64 1 0 11 65 1 0 12 66 1 0 12 67 1 0 13 68 1 0 17 69 1 1 23 77 1 0 24 78 1 6 25 79 1 0 25 80 1 0 27 81 1 0 36 86 1 6 35 85 1 0 33 84 1 0 30 83 1 0 29 82 1 0 40 87 1 6 41 88 1 0 41 89 1 0 42 90 1 0 42 91 1 0 43 92 1 0 43 93 1 0 44 94 1 0 48 95 1 6 49 96 1 0 49 97 1 0 49 98 1 0 51 99 1 0 51100 1 0 51101 1 0 18 70 1 0 19 71 1 0 19 72 1 0 19 73 1 0 20 74 1 0 20 75 1 0 20 76 1 0 M END