RDKit 3D 105110 0 0 0 0 0 0 0 0999 V2000 6.0880 3.8870 0.2534 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0036 2.3761 0.2694 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5854 1.8861 1.5592 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5659 1.9411 0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5518 0.4336 0.2341 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1583 -0.0853 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5629 -0.2034 1.4874 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1954 -0.6954 1.7431 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4646 -0.6615 0.4189 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9798 -1.0060 0.5225 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2766 -2.1416 1.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6732 0.2145 1.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5217 0.9305 0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6344 0.0163 -0.3625 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4247 -0.2564 0.7537 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6801 0.2987 0.6988 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9232 1.1790 1.7575 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8512 2.1319 1.3441 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2706 2.9574 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1183 3.8857 2.3219 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7343 2.7039 3.7619 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0466 1.4981 0.6723 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.1188 1.8152 -0.6931 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1038 0.0090 0.8959 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.6522 -0.2199 2.1709 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8098 -0.7053 0.6990 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.8057 -1.5253 -0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0303 -1.2268 -0.9804 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6822 -2.4771 -0.5302 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3284 -1.0854 -2.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7207 -1.0026 -2.6533 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5415 -1.1584 -0.8455 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8280 -2.3121 -1.5116 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5833 -1.8111 -1.8166 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3056 -1.3832 -0.5720 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9113 -2.6571 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4424 -0.4343 -0.9259 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8556 0.9059 -1.4223 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2963 -0.9381 -2.0411 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6974 -0.5077 -2.0894 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4321 -1.3710 -2.9037 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3644 -0.2901 -0.7558 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6542 -1.6763 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3507 -1.6022 1.0101 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 0.3331 -0.9686 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7435 1.8103 -0.9515 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0336 2.2761 -0.8945 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0809 4.3025 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8722 4.2735 -0.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3123 4.2851 1.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2883 2.6635 1.9425 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1977 0.9680 1.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7879 1.7836 2.3294 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8971 2.3504 0.8403 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2971 2.2550 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0051 0.2465 1.2405 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1679 0.1038 2.3667 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 -1.7210 2.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7457 -0.0753 2.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4701 0.4380 0.1355 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1982 -3.1420 1.0559 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 -2.0452 1.8245 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6835 -1.9854 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9454 0.9373 1.5532 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3343 -0.0658 1.9911 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9859 1.4544 -0.6485 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0587 1.7382 0.7247 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2071 0.6352 -1.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7449 0.8449 -0.2871 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 2.8111 0.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4396 3.4608 4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9532 1.9381 1.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4049 2.4759 -0.8734 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8583 -0.3897 0.1643 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3247 0.5000 2.3085 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6462 -1.3398 1.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3633 -2.3308 -0.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2584 -2.2532 0.4069 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5004 -2.7818 -1.2506 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0443 -3.3625 -0.4483 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0649 -2.0566 -2.9539 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8389 -0.2287 -2.9372 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9438 -0.1567 -3.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2318 -0.2587 -1.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2636 -2.5310 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8237 -3.2366 -0.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -2.7228 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5558 -1.0383 -2.5736 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2948 -3.3160 -0.8326 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1034 -3.3051 0.4534 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6249 -2.5086 0.8053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8574 0.7927 -1.8599 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9021 1.6881 -0.6349 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5025 1.3034 -2.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2638 -2.0482 -2.0787 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8117 -0.6288 -3.0189 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7469 0.4761 -2.6249 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9601 -1.4213 -3.7748 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4085 -2.1279 -0.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7795 -2.3267 -0.1774 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -2.4970 1.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0598 -0.0015 -1.9867 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4930 -0.0688 -0.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1927 2.2282 -1.8328 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2103 2.9622 -1.6061 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 1 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 18 19 1 0 19 21 1 0 19 20 2 0 14 28 1 0 28 29 1 1 28 30 1 0 30 31 1 0 28 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 1 35 37 1 0 37 38 1 6 37 39 1 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 1 1 43 44 1 0 42 45 1 0 45 46 1 0 46 47 1 0 46 2 1 0 42 5 1 0 37 6 1 0 35 9 1 0 32 10 1 0 26 16 1 0 1 48 1 0 1 49 1 0 1 50 1 0 3 51 1 0 3 52 1 0 3 53 1 0 4 54 1 0 4 55 1 0 5 56 1 1 7 57 1 0 8 58 1 0 8 59 1 0 9 60 1 6 11 61 1 0 11 62 1 0 11 63 1 0 12 64 1 0 12 65 1 0 13 66 1 0 13 67 1 0 14 68 1 6 16 69 1 6 18 70 1 6 22 72 1 1 23 73 1 0 24 74 1 6 25 75 1 0 26 76 1 1 27 77 1 0 21 71 1 0 29 78 1 0 29 79 1 0 29 80 1 0 30 81 1 0 30 82 1 0 31 83 1 0 32 84 1 6 33 85 1 0 33 86 1 0 34 87 1 0 34 88 1 0 36 89 1 0 36 90 1 0 36 91 1 0 38 92 1 0 38 93 1 0 38 94 1 0 39 95 1 0 39 96 1 0 40 97 1 6 41 98 1 0 43 99 1 0 43100 1 0 44101 1 0 45102 1 0 45103 1 0 46104 1 6 47105 1 0 M END