RDKit 3D 107111 0 0 0 0 0 0 0 0999 V2000 0.8305 -3.4583 0.3818 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2423 -2.2860 0.7954 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6214 -1.2376 -0.0531 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8388 -0.8203 0.6937 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1848 0.3690 0.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3962 1.4637 0.3613 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2404 2.0553 -0.7569 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6691 2.3198 -0.3886 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3464 1.3701 0.5495 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8426 0.3031 -0.1922 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1794 0.1175 -0.2101 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7653 0.3284 -1.4698 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1476 0.3026 -1.3928 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6749 0.5693 -2.8065 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1715 -0.4599 -3.5949 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6727 -1.0408 -0.9663 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4656 -0.8243 0.1818 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5299 -1.9392 -0.6222 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9932 -3.0661 0.0707 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5313 -1.2570 0.3051 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9472 -1.2734 1.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4452 0.8155 1.5972 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9902 -0.2736 2.4391 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0189 1.9397 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0455 1.1898 0.0106 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1933 2.1754 -1.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8282 1.5501 1.2455 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7924 0.4424 1.7489 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6847 0.1868 0.6059 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3254 1.4497 0.2827 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8504 -0.7201 0.6336 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0115 -0.5075 1.4849 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9821 -1.7722 1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0471 0.5036 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9266 0.5883 0.2494 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2611 0.4024 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1393 0.4926 -0.8950 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.8824 -0.8104 -1.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0833 1.6508 -0.6695 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3669 0.7507 -2.0069 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -0.7880 -0.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6974 -0.4201 -1.5314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8066 -0.5934 -0.3212 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9390 -2.1170 -0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3656 -0.2245 -0.4336 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4529 -4.2481 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9335 -3.4808 0.5476 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5614 -3.8093 -0.6242 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1616 -1.6988 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4641 -1.6476 1.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 2.3386 1.1075 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2859 1.2639 -1.5294 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8281 2.9619 -1.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 2.4226 -1.2937 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 3.3240 0.0916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1949 1.8767 1.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6631 0.8647 0.4502 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5092 1.1168 -0.7245 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7890 0.5514 -2.7322 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2893 1.5518 -3.0958 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2497 -0.2734 -4.5536 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2951 -1.4870 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4209 -0.9057 -0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0025 -2.3239 -1.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9470 -2.9048 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6075 -1.8885 0.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4681 -2.1068 1.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1903 -1.2307 1.9784 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8468 0.1400 3.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2156 -0.4819 3.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8016 2.0751 3.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 1.8186 2.9536 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0646 2.8817 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0703 3.2062 -0.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4638 1.8801 -1.9834 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1682 2.2066 -1.6403 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 1.6218 2.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3141 2.5389 1.2201 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2404 -0.4059 2.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3592 0.9209 2.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7637 2.3047 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2882 1.4870 -0.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5744 1.9304 1.3094 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5129 -1.7364 1.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7748 -0.8276 2.5718 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2885 -2.6168 1.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3610 -1.6019 0.1883 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7379 -1.7663 1.9904 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 0.2193 2.2925 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8122 1.5464 1.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6041 0.8263 -0.7505 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6570 0.1887 1.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5559 -1.6023 -0.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7194 -1.1798 -2.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9803 -0.5694 -1.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5585 2.5739 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0190 1.5414 -1.2619 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2801 1.7035 0.4171 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2389 1.7278 -2.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4543 -1.7512 -1.2364 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7383 -0.0588 -1.2964 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7103 0.5215 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5438 -1.2116 -2.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9164 -2.5323 -0.5771 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3148 -2.5573 -1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8375 -2.5458 0.7805 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2369 -0.1292 -1.5759 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 4 5 2 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 1 0 14 15 1 0 13 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 9 22 1 0 22 23 1 1 22 24 1 0 6 25 1 0 25 26 1 6 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 6 29 31 1 0 31 41 1 0 41 42 1 0 42 43 1 0 43 44 1 1 43 45 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 1 0 37 39 1 0 37 40 1 6 45 3 1 0 22 5 1 0 45 25 1 0 20 11 1 0 43 29 1 0 1 46 1 0 1 47 1 0 1 48 1 0 3 49 1 6 4 50 1 0 6 51 1 1 7 52 1 0 7 53 1 0 8 54 1 0 8 55 1 0 9 56 1 1 11 57 1 1 13 58 1 1 14 59 1 0 14 60 1 0 15 61 1 0 16 62 1 6 17 63 1 0 18 64 1 6 19 65 1 0 20 66 1 1 21 67 1 0 23 68 1 0 23 69 1 0 23 70 1 0 24 71 1 0 24 72 1 0 24 73 1 0 26 74 1 0 26 75 1 0 26 76 1 0 27 77 1 0 27 78 1 0 28 79 1 0 28 80 1 0 30 81 1 0 30 82 1 0 30 83 1 0 31 84 1 1 41100 1 0 41101 1 0 42102 1 0 42103 1 0 44104 1 0 44105 1 0 44106 1 0 45107 1 6 32 85 1 1 33 86 1 0 33 87 1 0 33 88 1 0 34 89 1 0 34 90 1 0 35 91 1 0 36 92 1 0 38 93 1 0 38 94 1 0 38 95 1 0 39 96 1 0 39 97 1 0 39 98 1 0 40 99 1 0 M END