RDKit 3D 123122 0 0 0 0 0 0 0 0999 V2000 14.5689 7.5056 -2.9374 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3149 6.0123 -2.7713 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1799 5.7933 -1.8299 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3647 5.1074 -0.7117 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2523 4.8563 0.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0462 3.3960 0.4298 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9174 2.7763 0.1651 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7601 1.3384 0.3319 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6507 0.6685 0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5729 -0.8131 0.2803 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4405 -1.1217 1.3249 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1428 -1.2650 0.5824 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6976 -0.5803 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 -0.8216 2.3496 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9415 -2.1401 2.8389 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9389 -3.3050 1.9337 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0851 -3.1838 0.7126 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 -2.9946 1.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -2.9079 -0.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4713 -2.9132 -1.3988 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5101 -2.8163 -0.2829 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7817 -2.7413 -1.4645 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2434 -1.6631 -1.5615 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2231 -1.7755 -0.5564 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3451 -0.9568 -0.4797 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4926 -0.0768 -1.3569 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3476 -1.1128 0.6043 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5691 -0.3052 0.2388 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6288 -0.4068 1.3138 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9113 0.3662 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9197 0.2609 1.9886 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2574 0.7968 1.8127 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5368 2.2194 1.5228 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0573 2.7965 0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9304 3.2469 -0.6554 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3929 3.1928 -0.4869 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0445 4.5893 -0.5524 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5037 5.4898 0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9810 6.8919 0.5211 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4232 7.1022 0.7589 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3160 6.5705 -0.3057 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0212 -4.0622 -1.5706 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8388 -4.0943 -0.4496 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8158 -5.4676 -0.4227 P 0 0 1 0 0 5 0 0 0 0 0 0 -2.5557 -5.6112 0.8738 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9882 -5.2246 -1.6492 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9614 -6.8907 -0.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7957 -7.7108 -1.4721 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1681 -9.0374 -1.8183 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1586 -9.7641 -2.6074 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -9.8036 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -9.3621 0.1734 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3016 -11.0568 -0.3916 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7284 8.0875 -2.4865 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5970 7.7202 -4.0209 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5400 7.7772 -2.4965 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0514 5.5359 -3.7571 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2346 5.5342 -2.4225 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1985 6.2019 -2.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3561 4.7221 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3725 5.3657 -0.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5782 5.2738 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8563 2.7535 0.7849 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0824 3.3531 -0.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6142 0.7804 0.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7945 1.2252 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9667 -1.3098 -0.6293 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4241 -2.0699 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5417 -0.8272 -0.2762 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0331 -2.3291 0.4948 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4711 -0.7514 2.6366 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7894 0.5510 1.6742 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1894 -0.0156 3.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5715 -0.5004 1.5802 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8614 -2.0238 3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4599 -2.4480 3.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 -4.1411 2.5407 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8833 -3.7834 1.6926 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4471 -2.3874 0.0062 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1623 -4.1311 0.1397 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3179 -3.9055 1.6027 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3945 -2.1081 1.6122 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4164 -2.7279 -2.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2078 -0.6451 -1.5929 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7528 -1.7822 -2.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9445 -0.8259 1.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6801 -2.1693 0.7059 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2385 0.7405 0.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9547 -0.7284 -0.7337 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8665 -1.4302 1.5895 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 0.1331 2.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6109 1.3891 0.6228 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2913 -0.1342 -0.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0192 -0.8355 2.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4674 0.7529 2.9091 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8805 0.1708 1.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8338 0.5793 2.7946 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9449 2.7996 2.3422 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5813 2.5230 1.7991 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0238 2.9381 -0.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5187 3.6745 -1.5814 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7678 2.6979 -1.4512 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7821 2.5719 0.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9236 4.9538 -1.5814 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1402 4.3813 -0.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3704 5.5426 0.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6305 4.9999 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7081 7.4200 -0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3603 7.5003 1.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7231 6.6170 1.7489 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6278 8.2060 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0909 7.3761 -0.5544 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9250 5.7081 0.0215 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8312 6.3494 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5939 -4.0776 -2.5167 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -4.8626 -1.5472 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8702 -5.0535 -1.2706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7931 -7.8506 -1.0207 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9779 -7.1846 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2551 -8.8195 -2.4308 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2945 -10.7370 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1153 -9.5607 -3.6091 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7511 -11.7419 0.0819 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 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 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 22 42 1 0 42 43 1 0 44 43 1 1 44 45 2 0 44 46 1 0 44 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 1 0 51 52 2 0 51 53 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 4 60 1 0 5 61 1 0 5 62 1 0 6 63 1 0 7 64 1 0 8 65 1 0 9 66 1 0 10 67 1 6 11 68 1 0 12 69 1 0 12 70 1 0 13 71 1 0 13 72 1 0 14 73 1 0 14 74 1 0 15 75 1 0 15 76 1 0 16 77 1 0 16 78 1 0 17 79 1 0 17 80 1 0 18 81 1 0 18 82 1 0 22 83 1 6 23 84 1 0 23 85 1 0 27 86 1 0 27 87 1 0 28 88 1 0 28 89 1 0 29 90 1 0 29 91 1 0 30 92 1 0 30 93 1 0 31 94 1 0 31 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 34100 1 0 35101 1 0 36102 1 0 36103 1 0 37104 1 0 37105 1 0 38106 1 0 38107 1 0 39108 1 0 39109 1 0 40110 1 0 40111 1 0 41112 1 0 41113 1 0 41114 1 0 42115 1 0 42116 1 0 46117 1 0 48118 1 0 48119 1 0 49120 1 6 50121 1 0 50122 1 0 53123 1 0 M END