RDKit 3D 100105 0 0 0 0 0 0 0 0999 V2000 4.0776 -2.0446 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0962 -0.9994 -0.5976 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0607 -1.3054 -2.0439 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4625 -2.4763 -2.4507 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 0.3209 -0.4578 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7704 0.2896 0.5808 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0811 0.3632 0.1708 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8922 -0.6532 0.6093 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1354 -0.6563 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5935 0.7363 -0.3428 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3022 1.0443 -1.6524 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0826 1.7630 0.6263 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5783 1.5581 1.9085 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5927 1.7286 0.6571 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0973 1.9731 1.9416 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9878 1.5292 -0.5070 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3367 2.4237 -1.5445 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5332 1.2728 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0439 0.1980 0.3441 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3746 0.9034 1.6873 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4089 0.1153 0.2727 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0639 0.5897 1.5769 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4784 0.9779 1.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1895 0.0988 0.4784 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5681 0.3782 -0.0513 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2140 1.5689 0.5515 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4443 1.9278 -0.2616 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2027 3.3015 -0.9233 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 2.1403 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5849 2.0294 1.8293 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8431 2.4700 0.0157 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6842 0.9908 -1.4008 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5776 -0.4567 -1.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4759 -0.7912 -0.0742 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2207 -1.0780 1.1675 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0219 -0.5598 2.2832 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2427 -2.0226 1.0767 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7631 -2.0675 -0.4897 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3584 -1.7676 -0.9808 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5206 -1.2185 0.1939 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7677 -2.2202 1.3258 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0757 -1.1717 -0.0860 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8801 -1.5214 -1.5536 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2878 -2.2454 0.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1207 -2.3183 0.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -1.0534 0.2185 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9409 -2.0488 -0.6947 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4194 -1.7458 0.9924 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5942 -3.0418 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1314 -1.4077 -2.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.4245 -2.6679 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0568 -3.2467 -2.5124 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5006 0.3818 -1.3812 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1676 0.4208 -0.9516 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8798 -1.1980 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0687 -1.2300 -0.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7137 0.7248 -0.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8919 1.9391 -1.7192 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3763 2.7880 0.2679 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6736 2.4600 2.3266 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1578 2.4838 -0.0219 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7452 1.7086 2.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1943 2.1216 0.4331 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5386 1.8254 -2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 1.1288 -1.6608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0047 2.2154 -0.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2452 1.9919 1.5871 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4757 0.7871 1.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 0.4238 2.5359 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7557 0.9258 -0.4684 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.5537 1.9333 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0288 -0.1040 2.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8954 1.9328 1.4075 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4563 0.6635 -1.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3947 1.5442 1.6334 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4789 2.4260 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8808 3.9891 -0.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4738 3.2356 -1.7324 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1610 3.6964 -1.3018 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5506 2.9852 0.5352 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7265 1.1817 -1.7583 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0429 1.3076 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2406 -0.9682 -2.0503 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5318 -0.9449 -0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2245 -2.7903 0.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3154 -2.4769 -1.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7714 -2.8536 0.2801 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9669 -2.6916 -1.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -0.9949 -1.7407 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8268 -3.2252 0.8426 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7453 -2.0819 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0339 -2.1848 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1634 -1.2129 -1.8802 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6272 -1.1139 -2.2277 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8675 -2.6211 -1.6198 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2051 -2.0749 1.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7951 -3.1952 0.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0145 -2.7149 -0.9035 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5883 -3.1722 0.6879 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3139 -1.1430 1.2959 H 0 0 0 0 0 0 0 0 0 0 0 0 28 27 1 0 27 32 1 0 32 33 1 0 33 34 1 0 34 38 1 0 38 39 1 0 39 40 1 0 40 41 1 1 40 24 1 0 24 23 2 0 23 22 1 0 22 21 1 0 21 19 1 0 19 20 1 1 19 18 1 0 18 16 1 0 16 17 1 0 16 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 5 2 1 0 2 1 1 1 2 3 1 0 3 4 1 0 2 46 1 0 46 45 1 0 45 44 1 0 44 42 1 0 42 43 1 6 24 25 1 0 25 26 1 0 34 35 1 1 35 37 1 0 35 36 2 0 27 29 1 1 29 31 1 0 29 30 2 0 26 27 1 0 25 34 1 0 42 40 1 0 42 21 1 0 46 19 1 0 14 7 1 0 28 77 1 0 28 78 1 0 28 79 1 0 32 81 1 0 32 82 1 0 33 83 1 0 33 84 1 0 38 86 1 0 38 87 1 0 39 88 1 0 39 89 1 0 41 90 1 0 41 91 1 0 41 92 1 0 23 73 1 0 22 71 1 0 22 72 1 0 21 70 1 6 20 67 1 0 20 68 1 0 20 69 1 0 18 65 1 0 18 66 1 0 16 63 1 1 17 64 1 0 5 53 1 6 7 54 1 6 9 55 1 0 9 56 1 0 10 57 1 6 11 58 1 0 12 59 1 6 13 60 1 0 14 61 1 6 15 62 1 0 1 47 1 0 1 48 1 0 1 49 1 0 3 50 1 0 3 51 1 0 4 52 1 0 46100 1 1 45 98 1 0 45 99 1 0 44 96 1 0 44 97 1 0 43 93 1 0 43 94 1 0 43 95 1 0 25 74 1 6 26 75 1 0 26 76 1 0 37 85 1 0 31 80 1 0 M END