RDKit 3D 160168 0 0 0 0 0 0 0 0999 V2000 1.5974 4.6441 2.7568 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6113 5.1369 1.8909 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 4.5807 0.6403 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 3.6378 0.0964 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 3.1542 -1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1407 2.1462 -1.8392 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1626 1.9607 -1.5788 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9116 0.9998 -2.4133 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3977 0.1253 -3.0925 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2208 1.3080 -2.3415 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0032 0.9271 -3.4931 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4041 1.5344 -3.3300 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2583 2.9001 -2.9077 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5106 3.4918 -2.5476 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3254 4.8103 -1.9952 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6673 4.7151 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3503 4.3359 0.3595 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6432 4.1592 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2617 4.3838 1.5882 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5115 4.0905 2.8075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9566 2.8817 2.9765 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2046 2.5644 4.2023 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0864 3.2867 5.1767 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6305 1.3508 4.0387 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1217 0.8210 5.1632 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2580 -0.6960 4.9354 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0986 -1.3935 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1006 -1.3268 5.9006 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4276 -0.8005 5.9261 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1096 -1.0480 4.6962 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6865 -2.3500 4.6024 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6788 -3.4489 4.1968 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7759 -3.0356 3.1625 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1711 -3.2072 1.8027 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8134 -1.9720 1.1426 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8028 -2.0134 -0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8458 -2.7876 -0.8703 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7351 -2.7791 -2.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2792 -3.4778 -2.9627 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1199 -4.2278 -2.1782 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3015 -4.7882 -2.7707 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1760 -3.7333 -3.1695 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3704 -4.2094 -3.8093 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1367 -2.9807 -4.3082 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3573 -2.3048 -5.2971 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1954 -5.0335 -2.8099 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3518 -5.6187 -3.4121 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3289 -6.1755 -2.2652 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0278 -6.8679 -1.2191 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9978 -5.6634 -1.7122 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1836 -6.7872 -1.3454 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3678 -3.3776 -4.3564 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5595 -2.6106 -5.0549 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -2.4884 -6.4102 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5769 -1.9441 -4.3939 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6501 -2.0128 -3.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7318 -1.3225 -2.3896 O 0 0 0 0 0 3 0 0 0 0 0 0 2.6865 -1.2044 -0.9631 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -0.2456 -0.4168 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7876 0.1171 -1.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7429 1.0187 -0.7192 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8622 1.4316 -1.3985 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 0.9663 -2.7333 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5967 1.5760 0.5617 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 2.4357 0.9952 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4953 1.2606 1.3527 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1754 1.7165 2.6014 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0322 2.6767 3.2063 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5451 0.3611 0.8482 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6684 -3.5166 1.6235 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0142 -3.7584 0.2425 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0593 -4.7368 2.4652 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4875 -4.7198 2.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3726 -4.7752 3.8423 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3845 -5.8169 3.7728 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4298 0.7124 6.2072 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9844 0.9804 7.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5226 1.4612 5.2284 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4955 2.8393 5.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5986 4.8304 0.4388 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3046 5.0030 -0.7531 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3801 3.6116 -3.8112 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6787 4.1480 -3.5227 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5614 2.2149 -4.4147 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.2451 2.2859 -5.6742 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2162 1.5061 -4.6315 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4642 0.1732 -5.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 3.6174 -1.9502 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9836 4.5579 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 5.0297 -0.1302 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6386 5.9515 0.3742 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 4.9030 2.3766 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 3.5644 2.9032 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 5.1286 3.7297 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9739 3.2680 0.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6153 1.5703 -2.6336 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7251 2.5461 -0.8632 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0566 -0.1645 -3.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5169 1.3352 -4.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9132 0.9740 -2.5343 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0339 2.8655 -1.8103 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4215 4.1582 0.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1744 3.8335 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4425 4.8797 3.5521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 2.0999 2.2307 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4274 1.0138 6.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6603 -0.8727 3.9308 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5533 -1.2677 5.9908 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7905 -1.0104 4.2462 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9793 -2.4714 4.8459 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9482 -1.2967 6.7539 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1883 -2.6196 5.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4869 -2.2564 3.8677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0298 -3.6235 5.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5661 -4.0277 1.3993 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -3.3611 -0.2759 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0146 -5.4173 -3.6241 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -4.8142 -4.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0928 -3.2549 -4.7627 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3126 -2.2804 -3.4842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7251 -1.3959 -5.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5323 -4.4133 -1.9696 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0550 -4.9457 -3.4542 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1483 -6.9256 -3.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8891 -7.1245 -1.6069 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1651 -5.0863 -0.7943 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7656 -7.3603 -0.8049 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -3.8809 -4.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3238 -2.8717 -6.7496 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3026 -1.3515 -4.9378 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8944 -0.3271 -2.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1895 1.2809 -3.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9376 1.4185 -3.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1539 -0.1208 -2.7566 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1828 2.5534 0.2423 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5907 2.9473 4.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0933 3.5926 2.6112 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0196 2.2512 3.4098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6855 0.1643 1.4874 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2643 -2.6405 1.8922 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -4.1017 0.2711 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8284 -5.6473 1.8971 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7529 -5.5805 2.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0808 -5.0613 4.6279 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8971 -5.8358 4.6175 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4501 1.1070 6.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9378 1.9561 7.6078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9634 1.4556 4.2258 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5631 3.1279 5.7549 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5309 5.0351 0.4577 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7893 5.3269 -1.6531 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9149 4.2814 -4.5445 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5282 5.0184 -3.1025 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2051 1.6038 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0041 2.8879 -5.5259 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6676 2.0233 -5.4291 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 0.2976 -5.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2897 3.2618 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8296 4.9218 -1.9893 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3173 6.1425 1.2771 H 0 0 0 0 0 0 0 0 0 0 0 0 32 31 1 0 86 87 1 0 84 85 1 0 82 83 1 0 3 2 1 0 8 7 1 0 2 1 1 0 4 3 2 0 8 10 1 0 6 5 1 0 3 90 1 0 41 50 1 0 50 48 1 0 48 46 1 0 46 43 1 0 43 42 1 0 42 41 1 0 46 47 1 0 48 49 1 0 50 51 1 0 90 89 2 0 8 9 2 0 53 52 1 0 89 88 1 0 52 39 2 0 39 38 1 0 25 78 1 0 56 55 1 0 55 53 2 0 56 38 1 0 78 76 1 0 76 29 1 0 29 28 1 0 28 26 1 0 26 25 1 0 29 30 1 0 56 57 2 0 38 37 2 0 37 36 1 0 36 58 2 0 58 57 1 0 53 54 1 0 39 40 1 0 58 59 1 0 36 35 1 0 59 69 2 0 78 79 1 0 69 66 1 0 88 5 2 0 66 64 2 0 7 6 2 0 64 61 1 0 90 91 1 0 61 60 2 0 60 59 1 0 5 4 1 0 61 62 1 0 14 82 1 0 62 63 1 0 82 84 1 0 64 65 1 0 84 86 1 0 66 67 1 0 31 30 1 0 86 12 1 0 12 13 1 0 22 21 1 0 13 14 1 0 21 20 2 0 20 19 1 0 22 23 2 0 34 33 1 0 33 32 1 0 18 19 2 0 32 74 1 0 19 80 1 0 74 72 1 0 80 81 2 0 72 70 1 0 81 16 1 0 70 34 1 0 16 17 2 0 17 18 1 0 24 22 1 0 16 15 1 0 44 45 1 0 74 75 1 0 67 68 1 0 12 11 1 0 11 10 1 0 14 15 1 0 26 27 1 0 25 24 1 0 76 77 1 0 72 73 1 0 70 71 1 0 34 35 1 0 43 44 1 0 41 40 1 0 7 97 1 0 6 96 1 0 4 95 1 0 89159 1 0 88158 1 0 91160 1 0 1 92 1 0 1 93 1 0 1 94 1 0 14101 1 1 86156 1 6 87157 1 0 84154 1 1 85155 1 0 82152 1 6 83153 1 0 12100 1 1 77147 1 0 25106 1 1 29111 1 1 27108 1 0 27109 1 0 27110 1 0 26107 1 6 76146 1 1 78148 1 6 79149 1 0 34115 1 6 74144 1 1 75145 1 0 71141 1 0 70140 1 1 32114 1 1 31112 1 0 31113 1 0 73143 1 0 72142 1 6 41117 1 6 46122 1 1 47123 1 0 48124 1 6 49125 1 0 50126 1 1 51127 1 0 44119 1 0 44120 1 0 43118 1 6 52128 1 0 55130 1 0 37116 1 0 54129 1 0 69139 1 0 60131 1 0 63132 1 0 63133 1 0 63134 1 0 65135 1 0 21105 1 0 20104 1 0 18103 1 0 80150 1 0 81151 1 0 17102 1 0 45121 1 0 68136 1 0 68137 1 0 68138 1 0 11 98 1 0 11 99 1 0 M CHG 1 57 1 M END