RDKit 3D 122124 0 0 0 0 0 0 0 0999 V2000 10.5936 0.8235 1.7775 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0441 1.0482 2.0512 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0147 0.1021 1.4176 C 0 0 2 0 0 0 0 0 0 0 0 0 14.4197 0.5496 1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2038 0.2223 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1562 0.0623 -1.0262 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4277 -1.2426 -1.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4485 -1.2838 -2.2428 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3516 -0.2956 -2.2234 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4385 -0.4891 -1.0133 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3408 0.5037 -1.0868 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3448 0.4376 0.0494 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7545 -0.9089 0.1797 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5641 -1.8180 0.6789 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4672 -1.3259 -0.1556 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1313 -2.7491 0.1351 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -0.5335 -0.7627 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4119 -0.9123 -2.3063 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4405 -0.1554 -2.8971 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1196 -0.5071 -0.3286 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1485 -0.4063 -1.1967 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6144 -0.5683 1.0132 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1663 -0.4993 1.1703 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1966 0.9329 0.5715 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2592 -0.4126 2.5655 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6023 -0.4343 3.4357 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7059 -0.2834 2.8267 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9671 -0.1660 3.0915 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0829 -0.3255 2.1491 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2416 0.0090 2.7047 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2166 -0.7374 0.8478 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -1.2957 0.2167 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4298 -0.7251 0.0778 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2536 -1.8986 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6205 -2.9267 0.7401 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6823 -1.9696 0.3537 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6945 -2.0886 -0.6112 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.5615 -3.2933 -0.1558 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5446 -1.0107 -1.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8410 -0.2698 -1.9874 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8186 -0.5125 -0.9742 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.8529 -0.3478 -0.0216 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.4705 -0.4201 1.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3326 -0.5517 1.8081 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5177 -0.3305 2.3243 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5562 1.0670 -0.1196 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4206 2.0381 -0.5128 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5084 2.3210 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4030 2.7612 -2.5643 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1881 2.9078 -1.8912 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2188 3.3166 -2.7563 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1349 2.6133 -0.5053 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2605 2.1958 0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6633 2.2907 -0.0621 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3176 0.9636 0.2816 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9996 0.6437 0.1038 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1005 1.5898 -0.3499 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4065 2.9078 -0.6685 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7659 3.2316 -0.5028 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2440 4.5366 -0.7685 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3510 -0.2724 1.7772 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1958 1.3050 0.8986 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9628 1.2035 2.6637 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3349 2.1074 1.7628 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1924 1.0490 3.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8183 -0.9200 1.8128 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7816 1.3317 1.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2228 0.9664 3.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0338 -0.3560 1.9981 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0297 -0.5713 -0.2831 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7201 1.2193 -0.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4284 0.9220 -1.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6445 0.2149 -2.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1657 -2.0691 -1.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9014 -1.4864 -0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0622 -2.3429 -2.2834 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0460 -1.1702 -3.1956 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7254 0.7640 -2.1774 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6826 -0.4352 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0458 -1.5437 -1.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9825 -0.4744 -0.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7989 1.5258 -1.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8037 0.3433 -2.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5874 1.2184 -0.0941 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9027 0.6783 0.9946 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7258 -3.3592 -0.6006 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5272 -3.0002 1.1298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0732 -2.9502 -0.0339 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 0.5222 -0.8035 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 -0.5766 -2.7099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2749 -1.9776 -2.3688 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8307 -0.6903 -3.4294 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 -0.6699 1.7998 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3225 -1.1969 0.5457 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5652 0.8081 -0.4228 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 1.5718 0.7484 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 1.3180 1.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -0.0158 4.1179 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2437 -0.8870 3.9965 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2723 0.8334 3.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3975 -1.6795 1.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4428 -0.6047 -0.3731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3024 -2.2536 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0756 -1.0125 -0.9792 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1037 -1.9800 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1872 -2.5907 -1.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2858 -2.9291 0.5815 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9441 -4.1456 0.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1792 -3.6335 -1.0355 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1841 -0.0961 -1.9698 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6823 -1.0563 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4495 -0.8785 3.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0995 1.2201 0.7448 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2524 0.8967 -0.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4744 2.2095 -2.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4834 3.0008 -3.6219 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 3.6206 -2.7873 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2540 2.1733 1.3604 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0069 0.2787 0.8422 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0226 1.3129 -0.4919 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7142 3.6234 -0.9997 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5922 5.2062 -1.0962 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 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 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 17 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 1 0 31 33 1 0 33 56 1 0 56 57 1 0 57 58 2 0 58 59 1 0 59 60 1 0 59 54 2 0 54 55 1 0 54 52 1 0 52 53 1 0 53 47 2 0 47 46 1 0 46 42 1 0 42 41 1 0 41 39 1 0 39 40 2 0 39 37 1 0 37 38 1 0 37 36 1 0 36 34 1 0 34 35 2 0 42 43 1 0 43 45 1 0 43 44 2 0 47 48 1 0 48 49 2 0 49 50 1 0 50 51 1 0 34 33 1 0 55 56 2 0 50 52 2 0 1 61 1 0 1 62 1 0 1 63 1 0 2 64 1 0 2 65 1 0 3 66 1 6 4 67 1 0 4 68 1 0 4 69 1 0 5 70 1 0 5 71 1 0 6 72 1 0 6 73 1 0 7 74 1 0 7 75 1 0 8 76 1 0 8 77 1 0 9 78 1 0 9 79 1 0 10 80 1 0 10 81 1 0 11 82 1 0 11 83 1 0 12 84 1 0 12 85 1 0 16 86 1 0 16 87 1 0 16 88 1 0 17 89 1 6 18 90 1 0 18 91 1 0 19 92 1 0 22 93 1 0 23 94 1 6 24 95 1 0 24 96 1 0 24 97 1 0 27 98 1 0 28 99 1 0 28100 1 0 32101 1 0 32102 1 0 32103 1 0 33104 1 6 57120 1 0 58121 1 0 60122 1 0 55119 1 0 53118 1 0 46113 1 0 46114 1 0 42111 1 6 41110 1 0 37106 1 6 38107 1 0 38108 1 0 38109 1 0 36105 1 0 45112 1 0 48115 1 0 49116 1 0 51117 1 0 M END