RDKit 3D 106111 0 0 0 0 0 0 0 0999 V2000 6.3572 6.1286 -2.8817 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0858 6.3330 -2.5901 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2674 5.3434 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9982 5.5029 -1.5664 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1892 6.7008 -1.8842 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 4.2973 -0.8472 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3592 3.6650 -1.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9267 2.4042 -1.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0348 2.2963 -0.0328 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1812 1.0504 0.3812 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 0.5178 1.3928 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3621 -0.0260 0.6895 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8993 -1.0792 0.0785 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1504 -0.7992 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0573 -1.7360 -1.0627 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0801 -2.3039 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2004 -2.0850 1.1658 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2520 -2.7709 1.6468 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6636 -2.7541 3.0538 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6625 -3.4435 3.3654 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8298 -3.4550 0.6025 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0206 -4.3416 0.6813 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0765 -3.1518 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4140 -3.7385 -1.8671 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4806 -4.8910 -2.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5918 -5.8779 -1.1406 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4114 0.4884 0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6776 1.2755 -0.2327 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2925 0.9839 0.6675 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7401 2.1872 1.3547 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 3.3500 1.1386 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7306 1.5952 2.2603 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6780 2.4928 2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5284 2.1779 2.5529 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9067 3.7071 3.3573 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1839 4.5177 3.7758 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7156 0.2443 -0.3263 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9081 -1.2129 -0.1891 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7115 -1.6599 0.9796 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -1.1114 0.9327 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3008 0.1045 1.1929 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1542 -1.8970 0.6123 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4856 -1.4547 0.5548 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3584 -2.1997 1.5435 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4523 -2.7125 2.6309 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3657 -3.9391 2.8965 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6709 -1.8609 3.3902 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9975 -3.3004 0.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 -3.8021 -0.2623 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9902 -5.2049 -0.5952 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7605 -5.6472 -1.7382 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4842 -6.0824 0.3655 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 -3.0027 -1.2006 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0377 -1.5759 -0.8548 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0777 -1.0768 -1.7232 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3954 1.1276 -1.1892 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3928 0.6810 -2.1735 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6089 3.4278 -0.7637 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7135 4.0426 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8715 3.5374 -1.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9248 6.8959 -3.4153 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9134 5.2454 -2.6347 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6146 7.2667 -2.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1292 6.4126 -2.0683 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5602 7.2388 -2.7737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2122 7.4410 -1.0495 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1367 4.6141 0.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4677 4.3547 -1.6157 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6642 3.4293 -2.6651 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5559 3.1373 0.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7154 -0.3083 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4093 -2.0058 -0.0471 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5038 -1.1707 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4478 -2.5506 -1.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5366 -1.4565 1.6941 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1527 -2.1906 3.7893 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9592 -3.7612 0.7714 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9584 -4.9890 1.5955 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0954 -4.9566 -0.2266 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4754 -4.0174 -1.9393 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1933 -2.9808 -2.6686 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7035 -5.4088 -3.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4498 -4.5517 -2.1592 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8623 -6.7485 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4806 2.2106 -0.7573 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1184 1.5180 0.7506 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3296 0.6441 -0.8595 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2398 1.0898 3.1357 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1533 5.4338 4.2643 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8168 3.9701 4.5109 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 4.7291 2.9023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1005 -1.7064 -0.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3734 -1.6212 -1.1326 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8257 -2.7861 0.8692 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2643 -1.5181 1.9656 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5106 -0.3901 0.8213 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1001 -1.5478 2.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9752 -1.4363 4.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8565 -6.9722 0.0912 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0657 -3.3367 -2.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9654 -0.9943 -1.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 -0.3299 -2.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4748 -0.4254 -2.2511 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3841 1.0863 -2.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9824 0.9805 -3.1859 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6347 2.4762 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 36 35 1 0 35 33 1 0 33 34 2 0 33 32 1 0 32 11 1 0 11 10 1 0 10 37 2 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 42 43 1 0 43 54 1 0 54 55 1 0 54 53 1 0 53 49 2 0 49 48 1 0 48 44 1 0 44 45 1 0 45 47 1 0 45 46 2 0 49 50 1 0 50 52 1 0 50 51 2 0 37 56 1 0 56 57 1 0 56 8 2 0 8 7 1 0 7 6 1 0 6 58 1 0 58 59 1 0 59 60 2 0 59 3 1 0 3 2 1 0 2 1 2 3 3 4 2 0 4 5 1 0 8 9 1 0 11 12 1 0 12 29 2 0 29 27 1 0 27 28 1 0 27 14 2 0 14 15 1 0 15 16 1 0 16 23 2 0 23 24 1 0 24 25 1 0 25 26 1 0 23 21 1 0 21 22 1 0 21 18 2 0 18 17 1 0 18 19 1 0 19 20 2 0 14 13 1 0 29 30 1 0 30 31 2 0 30 32 1 0 9 10 1 0 13 12 1 0 44 43 1 0 4 6 1 0 17 16 1 0 36 89 1 0 36 90 1 0 36 91 1 0 32 88 1 1 11 71 1 1 38 92 1 0 38 93 1 0 39 94 1 0 39 95 1 0 43 96 1 1 54101 1 1 55102 1 0 53100 1 0 44 97 1 1 47 98 1 0 52 99 1 0 57103 1 0 57104 1 0 57105 1 0 7 68 1 0 7 69 1 0 6 67 1 1 58106 1 0 2 63 1 0 1 61 1 0 1 62 1 0 5 64 1 0 5 65 1 0 5 66 1 0 9 70 1 0 28 85 1 0 28 86 1 0 28 87 1 0 15 73 1 0 15 74 1 0 24 80 1 0 24 81 1 0 25 82 1 0 25 83 1 0 26 84 1 0 22 77 1 0 22 78 1 0 22 79 1 0 17 75 1 0 19 76 1 0 13 72 1 0 M END