RDKit 3D 117118 0 0 0 0 0 0 0 0999 V2000 11.7625 3.4846 -1.7389 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2693 2.1896 -1.6877 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6542 1.4695 -2.7622 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6654 0.9760 -3.7031 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3859 0.7910 -3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7762 1.0746 -2.2316 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4551 0.8784 -2.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8448 1.1670 -0.7844 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5581 0.9874 -0.6059 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7897 0.5030 -1.7183 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4636 0.3160 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6488 -0.1601 -2.5985 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4012 -0.4304 -2.5988 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4523 -0.3483 -1.4953 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1912 -0.4453 -0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3008 -1.7153 -1.5537 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7714 -1.6493 -2.9447 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5039 -1.8586 -0.7914 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5292 -0.7888 -1.2539 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7081 -2.0791 0.6264 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1331 -2.1368 0.9256 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2386 -1.6989 2.2774 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4291 -2.3836 2.8675 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1588 -1.6478 3.9545 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8843 -2.0835 5.2361 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9790 -2.6960 5.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0302 -0.1507 3.8139 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9551 0.4144 4.6644 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7187 0.0366 2.3173 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9598 1.4919 1.9568 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4171 1.8294 2.2664 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7317 1.6701 0.4914 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6160 0.9107 -0.2396 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7359 3.1186 0.0629 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6366 3.8693 0.7777 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4313 3.1571 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4148 2.4333 -2.2484 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8343 2.8705 -2.2189 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0334 1.4169 -3.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9987 0.6592 -3.8624 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0353 -0.6938 -3.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4116 -0.3401 2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0161 -2.0517 3.0940 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4772 -2.3655 4.3996 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2818 -3.2854 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2887 -3.4347 1.1440 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0723 -4.0346 0.5643 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7420 0.4377 -2.4126 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3076 -0.5325 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1725 -0.5343 -0.8663 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2011 -1.5080 -0.9847 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4192 4.0628 -0.8321 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8907 3.4915 -1.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4459 4.0552 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2872 2.2192 -3.3971 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0269 0.7220 -4.7065 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8001 0.4056 -4.3565 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3212 1.4275 -1.3942 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9590 0.5181 -2.9316 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4292 1.5315 0.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 1.2096 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1801 0.2811 -2.6668 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 0.6258 -0.5769 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1888 -0.3173 -3.5741 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0055 -0.7811 -3.6086 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1925 0.4971 -1.6037 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0812 -1.1072 -0.2135 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5323 -1.1028 0.5273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2568 0.4795 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4288 -2.4870 -1.5468 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0639 -0.7255 -3.1295 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0279 -2.8139 -1.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3989 -0.8641 -0.5545 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1302 0.2233 -1.1441 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8801 -0.9934 -2.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3365 -1.3043 1.2748 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1278 -2.7717 2.0932 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0501 -3.3307 3.3667 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2561 -1.9471 3.7987 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7222 -3.0297 6.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3371 -3.5876 5.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8627 -1.9972 5.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0418 0.2735 4.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2988 1.3943 5.0915 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9741 0.5595 4.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6882 -0.1973 5.5603 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4818 -0.5698 1.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3265 2.1613 2.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8251 2.5630 1.5511 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9837 0.8753 2.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4903 2.2986 3.2781 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6644 1.3311 0.3136 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5154 -0.0398 -0.0683 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6792 3.6531 0.2926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 4.3830 0.0424 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0116 4.6547 1.4637 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9976 3.1287 1.2892 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4136 4.2085 -1.8008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3935 2.7863 -1.5921 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9456 3.8214 -1.6266 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5238 2.1027 -1.8121 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2387 3.1264 -3.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9951 1.0730 -3.0552 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5579 0.7157 -4.8956 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0127 1.0940 -3.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7403 -0.8849 -2.8265 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3423 -1.1724 3.2791 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8382 -2.8943 4.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2228 -3.2008 2.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6943 -4.2012 3.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1405 -4.1500 0.8849 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3098 -4.4198 -0.4506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1542 -4.9532 1.1689 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8257 -3.4287 0.5901 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6210 1.0094 -2.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0932 -0.0687 -3.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5271 -1.6255 -0.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 48 1 0 48 49 1 0 49 51 1 0 49 50 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 22 21 1 6 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 24 27 1 0 27 28 1 0 27 29 1 0 29 42 1 0 29 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 37 38 1 0 37 39 2 0 39 40 1 0 40 41 1 0 22 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 46 47 1 0 46 20 1 0 42 22 1 0 1 52 1 0 1 53 1 0 1 54 1 0 3 55 1 6 48115 1 0 48116 1 0 51117 1 0 4 56 1 0 5 57 1 0 6 58 1 0 7 59 1 0 8 60 1 0 9 61 1 0 10 62 1 0 11 63 1 0 12 64 1 0 13 65 1 0 14 66 1 1 15 67 1 0 15 68 1 0 15 69 1 0 16 70 1 6 17 71 1 0 18 72 1 6 19 73 1 0 19 74 1 0 19 75 1 0 20 76 1 1 23 77 1 0 23 78 1 0 24 79 1 6 26 80 1 0 26 81 1 0 26 82 1 0 27 83 1 1 28 84 1 0 28 85 1 0 28 86 1 0 29 87 1 6 30 88 1 1 31 89 1 0 31 90 1 0 31 91 1 0 32 92 1 1 33 93 1 0 34 94 1 6 35 95 1 0 35 96 1 0 35 97 1 0 36 98 1 0 36 99 1 0 38100 1 0 38101 1 0 38102 1 0 39103 1 0 40104 1 0 40105 1 0 41106 1 0 43107 1 1 44108 1 0 45109 1 0 45110 1 0 46111 1 1 47112 1 0 47113 1 0 47114 1 0 M END