RDKit 3D 111114 0 0 0 0 0 0 0 0999 V2000 -3.0738 2.0885 3.8887 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3572 1.0014 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4449 0.3291 3.6611 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7247 0.7333 1.8889 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1772 -0.2576 1.0299 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1233 -1.3739 0.7379 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9726 -1.2750 -0.3106 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3061 -1.1497 -0.4561 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9129 -1.0751 -1.8067 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9253 -1.1078 0.6043 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5475 -2.7980 0.9781 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9398 -3.5848 0.8711 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3194 -3.0386 2.4132 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -3.3646 -0.0977 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5745 -3.1137 -0.2623 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4459 -3.2133 0.6443 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6888 -2.9615 2.0288 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7283 -2.6552 -0.0658 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7726 -3.4200 0.5621 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4924 -4.3958 -0.0798 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5599 -5.1209 0.6833 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2578 -4.6652 -1.2633 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0876 -1.2589 0.1353 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1946 -0.8917 1.4909 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5458 -1.1677 -0.3526 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6353 -0.1057 -1.3900 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3907 1.1292 -0.8445 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4112 -0.4486 -2.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 -1.4884 -3.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1759 -1.6418 -4.5127 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2361 -2.2358 -3.1827 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2168 0.2109 -1.7034 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1360 1.5359 -2.1255 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1201 2.3449 -2.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4467 3.3536 -3.2656 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3642 2.1670 -2.4156 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6371 2.5199 -1.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5561 1.4214 0.0140 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9060 2.1370 1.2047 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6931 0.4925 -0.1872 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7922 1.4081 -0.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5162 1.4873 -1.5773 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2774 0.7354 -2.5206 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6153 2.4940 -1.6962 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6335 2.3766 -0.6185 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1815 2.4844 -3.0963 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8195 0.9086 0.2967 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6869 1.8646 0.7576 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1764 2.2764 1.9179 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7408 1.6427 2.8655 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1409 3.3864 1.9935 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5124 4.0391 0.8394 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4016 5.0653 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 5.4855 2.0532 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5973 4.8401 3.2152 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 3.7952 3.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3467 -0.1678 -0.5622 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6774 3.0935 3.6277 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1385 2.0240 3.5837 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0052 1.8865 4.9801 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4142 -0.7262 1.6386 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8222 -1.3348 1.6145 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1992 -1.3798 -2.5968 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8132 -1.7529 -1.7891 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3189 -0.0672 -2.0094 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5324 -3.1751 1.6617 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2889 -3.5424 -0.1427 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7183 -4.6466 1.1149 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8572 -2.2541 3.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9173 -4.0644 2.5235 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2834 -3.1495 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -4.0381 -0.8545 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3508 -2.8049 -1.3228 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -4.3549 0.6237 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4252 -1.9772 2.4545 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4193 -3.7936 2.7646 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8081 -3.0319 2.2472 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6378 -2.9231 -1.1036 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0907 -5.7729 1.4393 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2003 -5.7016 -0.0043 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1827 -4.3836 1.2015 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 -1.0360 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2502 -0.8953 0.4596 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9295 -2.0899 -0.7786 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2853 1.2519 0.2256 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5008 1.0101 -1.0281 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1125 2.0274 -1.4104 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.6728 -5.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8618 -2.4107 -5.2233 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 -1.8143 -4.0811 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9476 -0.4173 -2.5918 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.1478 -2.7331 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 2.9015 -3.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0034 3.3971 -0.7592 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6668 2.9331 -0.9365 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 2.9124 1.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5181 -0.1455 -1.0564 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1006 3.4928 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7455 3.3567 -0.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2589 1.6766 0.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6278 2.0612 -0.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5909 3.1240 -3.7875 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1981 2.9227 -3.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1769 1.4447 -3.4823 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6462 0.3914 1.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1143 3.7704 -0.1371 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7093 5.5972 -0.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6716 6.3150 2.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0479 5.1862 4.1259 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4108 3.2931 4.1125 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4219 -0.6379 -1.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 45 44 1 0 44 46 1 0 44 42 1 0 42 43 2 0 42 41 1 0 41 40 1 0 40 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 2 0 6 11 1 0 11 12 1 0 11 13 1 0 11 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 2 0 18 23 1 0 23 24 1 1 23 25 1 0 25 26 1 0 26 27 1 0 26 28 1 6 28 29 1 0 29 30 1 0 29 31 2 0 26 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 1 0 38 39 1 1 38 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 51 52 2 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 47 57 1 0 38 40 1 0 56 51 1 0 57 23 1 0 57 32 1 0 45 99 1 0 45100 1 0 45101 1 0 44 98 1 0 46102 1 0 46103 1 0 46104 1 0 40 97 1 6 5 61 1 1 1 58 1 0 1 59 1 0 1 60 1 0 6 62 1 1 9 63 1 0 9 64 1 0 9 65 1 0 12 66 1 0 12 67 1 0 12 68 1 0 13 69 1 0 13 70 1 0 13 71 1 0 14 72 1 0 15 73 1 0 16 74 1 1 17 75 1 0 17 76 1 0 17 77 1 0 18 78 1 6 21 79 1 0 21 80 1 0 21 81 1 0 24 82 1 0 25 83 1 0 25 84 1 0 27 85 1 0 27 86 1 0 27 87 1 0 30 88 1 0 30 89 1 0 30 90 1 0 32 91 1 6 36 92 1 0 36 93 1 0 37 94 1 0 37 95 1 0 39 96 1 0 47105 1 1 52106 1 0 53107 1 0 54108 1 0 55109 1 0 56110 1 0 57111 1 6 M END