RDKit 3D 126127 0 0 0 0 0 0 0 0999 V2000 4.3819 0.9511 -6.4116 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7624 0.2756 -5.2057 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0094 -0.3215 -5.0852 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7640 -0.2273 -6.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4442 -1.0202 -3.8863 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6734 -1.6466 -3.7121 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7059 -2.1660 -2.5233 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5544 -1.9313 -1.8574 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2898 -2.3872 -0.4999 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2161 -2.1276 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0521 -1.3363 -0.2899 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8512 -2.2446 -0.2107 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5522 -1.6111 -0.6160 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5249 -2.7145 -0.6526 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1486 -0.4181 0.2073 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8885 -0.5406 1.5826 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2531 -1.0735 2.3623 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2267 -0.9059 3.7684 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3558 -2.1135 4.3731 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4719 -0.2298 2.4720 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2719 -0.8620 3.6795 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4785 -0.2137 1.3984 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1911 -1.4959 1.0885 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2104 -1.1534 0.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2468 -0.0012 -0.4504 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1773 -2.1063 -0.5092 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2043 -1.3983 -1.3935 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5166 -3.1306 -1.5042 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6498 -3.9955 -1.9045 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 -5.0926 -2.8367 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2866 -5.5021 -3.3604 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2749 -6.5998 -4.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5096 -7.7814 -3.9554 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0147 -6.5459 -5.4634 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6963 -5.5151 -5.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9321 -2.3703 -2.4816 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5771 -2.3148 -2.5367 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3029 0.3364 -0.6056 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6248 1.5548 -1.1747 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7876 2.0057 -0.8589 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1625 2.3707 -2.0727 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3133 3.1432 -1.6178 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2932 2.3246 -1.0541 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1429 4.3552 -0.7935 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4557 4.1340 0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6202 4.7725 0.8555 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3461 4.6324 2.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4046 5.3495 2.2435 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0026 3.7366 3.2189 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3313 4.2072 3.8271 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 3.8916 4.2991 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0255 5.2335 4.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9046 5.2660 6.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4334 3.7222 3.6905 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 4.2368 4.2392 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5731 3.9023 3.4503 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1258 3.2097 2.4371 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9477 2.6729 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3294 1.9093 0.3386 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 2.8953 1.3595 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 3.1018 2.5923 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8178 -1.2321 -2.7256 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9489 0.2765 -7.1449 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2919 1.4909 -6.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6623 1.7579 -6.0984 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4427 -1.6702 -4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0821 -2.9910 -0.0372 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1816 -2.5617 1.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1044 -0.9222 -1.2818 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -0.4896 0.4325 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0459 -3.0421 -0.9759 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7952 -2.8115 0.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7002 -1.2579 -1.6464 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9589 -3.7196 -0.3794 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.4500 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1395 -2.8876 -1.7032 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1368 0.2227 0.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0518 0.5090 2.0605 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8155 -1.0484 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4584 -2.1156 2.2977 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5444 -2.7400 4.4377 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.8845 5.4622 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2496 -2.6958 4.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2769 0.8037 2.8061 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4804 -1.9125 3.4905 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2389 -0.3022 3.7486 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7185 -0.7193 4.6123 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1415 0.1990 0.4401 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2809 0.5106 1.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5422 -2.2547 0.6904 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7577 -1.9116 1.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6973 -2.6307 0.2922 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9163 -1.4152 -2.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1844 -0.3185 -1.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2149 -1.7803 -1.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7591 -3.6839 -0.9407 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0599 -4.4925 -0.9606 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5435 -3.3786 -2.2312 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3453 -5.6461 -3.1239 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3501 -5.0455 -3.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1307 -8.4220 -3.2812 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -7.4680 -3.3779 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1876 -8.3383 -4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0124 -7.3793 -6.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1094 -1.9105 -1.6056 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0437 -3.1941 -2.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -1.4996 -3.2981 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5036 1.7593 -2.9932 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5349 3.1189 -2.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8682 3.5178 -2.5859 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1525 2.7655 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 5.1943 -1.3559 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 4.8006 -0.5082 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8965 3.3793 1.1592 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0076 5.4993 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8939 2.7006 2.8817 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1211 5.1009 4.4926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 4.5479 3.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7257 3.4135 4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9218 3.2131 5.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8484 6.3047 6.4721 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0428 4.6780 6.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8264 4.8125 6.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7131 4.8106 5.1404 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4291 2.2147 -0.0925 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7954 1.0279 0.0248 H 0 0 0 0 0 0 0 0 0 0 0 0 19 18 1 0 18 17 1 0 17 16 1 0 16 15 1 0 15 38 1 0 38 39 1 0 39 40 2 0 39 41 1 0 41 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 45 46 2 0 46 47 1 0 47 48 2 0 47 49 1 0 49 50 1 0 49 51 1 0 51 52 1 0 52 53 1 0 51 54 1 0 54 55 2 0 55 56 1 0 56 57 1 0 57 61 2 0 57 58 1 0 58 59 1 0 58 60 2 0 15 13 1 0 13 14 1 0 13 12 1 0 12 11 1 0 11 10 1 0 10 9 2 0 9 8 1 0 8 62 2 0 62 5 1 0 5 6 2 0 6 7 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 1 0 17 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 2 0 28 36 1 0 36 37 1 0 61 54 1 0 7 8 1 0 19 81 1 0 19 82 1 0 19 83 1 0 17 80 1 6 16 78 1 0 16 79 1 0 15 77 1 1 41108 1 0 41109 1 0 42110 1 6 43111 1 0 44112 1 0 44113 1 0 45114 1 0 46115 1 0 49116 1 6 50117 1 0 50118 1 0 50119 1 0 51120 1 1 53121 1 0 53122 1 0 53123 1 0 55124 1 0 59125 1 0 59126 1 0 13 73 1 6 14 74 1 0 14 75 1 0 14 76 1 0 12 71 1 0 12 72 1 0 11 69 1 0 11 70 1 0 10 68 1 0 9 67 1 0 6 66 1 0 1 63 1 0 1 64 1 0 1 65 1 0 20 84 1 1 21 85 1 0 21 86 1 0 21 87 1 0 22 88 1 0 22 89 1 0 23 90 1 0 23 91 1 0 26 92 1 1 27 93 1 0 27 94 1 0 27 95 1 0 28 96 1 1 29 97 1 0 29 98 1 0 30 99 1 0 31100 1 0 33101 1 0 33102 1 0 33103 1 0 34104 1 0 37105 1 0 37106 1 0 37107 1 0 M END