RDKit 3D 123129 0 0 0 0 0 0 0 0999 V2000 -4.6692 -4.4029 0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2861 -3.5149 -1.0010 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2198 -4.3985 -2.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2647 -2.4070 -1.2765 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5428 -1.0848 -1.5633 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8871 -0.6971 -0.2331 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0121 -0.6472 0.7639 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0081 -1.4689 1.7124 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0336 0.2555 0.6756 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1076 0.3194 1.6084 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.3384 0.0908 1.0925 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9867 1.0730 0.4237 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.6402 1.1633 -1.0616 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3098 1.4150 -1.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9410 2.4454 1.0526 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.8638 2.5117 2.0899 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5727 2.7416 1.6333 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.6634 3.1332 0.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0268 1.5842 2.4036 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7342 1.3829 3.5946 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9155 -1.7676 0.1277 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8950 -2.9199 -0.8509 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5125 -1.2878 0.3106 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7955 -1.8960 1.2393 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -1.5907 1.6081 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1572 -0.6798 0.5329 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6029 -0.3427 0.7361 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9450 -0.2147 2.1764 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -1.5208 0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9116 -1.2445 0.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3089 0.0097 -0.5080 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5883 0.2985 -0.1262 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5648 0.1578 -1.0842 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3595 -0.8995 -0.7471 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4837 -0.7239 -0.0276 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1723 -0.6706 1.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0913 -0.5083 2.2938 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8844 -0.7934 1.8862 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1971 0.5423 -0.3789 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5666 0.3571 -0.2994 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7484 1.0078 -1.7346 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4241 2.1941 -2.0283 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2618 1.3704 -1.5501 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8445 1.7728 -2.8129 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4122 1.1639 -0.2319 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4361 2.1829 -1.3613 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9186 1.9010 1.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9608 0.7948 -0.1264 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1174 1.9640 0.2207 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 1.6576 -0.3348 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1884 0.4239 0.3422 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5124 0.8924 1.6005 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9509 -0.1761 -0.5030 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3648 -0.8116 -1.7688 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 0.8149 -0.9153 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3182 0.6808 -0.2798 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2018 1.4564 -1.0751 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4805 -5.4868 -0.1051 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7508 -4.2986 0.3901 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1055 -4.2040 1.0697 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2613 -4.7389 -2.4319 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8285 -3.7801 -3.0864 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5965 -5.2638 -1.9973 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8558 -2.2341 -0.3403 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9583 -2.6570 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3259 -0.3692 -1.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8103 -1.1867 -2.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8982 -0.5086 2.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0850 0.7953 0.4296 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9922 0.2076 -1.5382 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2235 1.9678 -1.5533 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1719 2.0608 -2.0313 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1421 3.2101 0.2944 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0299 3.4424 2.3871 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6932 3.6047 2.3202 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8217 3.3550 1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9501 1.8198 2.6362 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5595 0.8501 3.3779 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2665 -2.2303 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2142 -3.6959 -0.4186 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5309 -2.6728 -1.8458 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2472 -2.7217 1.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1946 -2.5336 1.5922 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6471 -1.1026 2.6143 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1424 -1.3234 -0.4004 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0314 -0.1154 2.3684 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6718 -1.1881 2.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 0.5791 2.7339 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2406 -2.4460 0.7375 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -1.6507 -0.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2995 -1.2486 1.2908 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4106 -2.0891 -0.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2052 -0.2689 -1.5769 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9797 -0.2141 -2.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2198 -1.5820 -0.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6152 -1.0675 2.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9278 1.3420 0.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9348 0.6298 -1.1891 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8748 0.2408 -2.5172 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4642 2.2489 -3.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2806 2.2183 -0.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1993 1.1328 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3277 2.1742 -1.9666 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3562 3.2260 -0.9351 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5722 2.0820 -2.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 2.8751 0.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1153 2.1799 1.6934 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7362 1.3110 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6705 0.4955 -1.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0165 2.0295 1.3114 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4962 2.9307 -0.1468 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7667 1.5953 -1.4337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1209 2.5581 -0.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8449 1.9617 1.4316 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 0.9479 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4435 0.3591 1.8293 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5796 -0.3208 -2.0808 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2839 -1.9045 -1.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0747 -0.6237 -2.6291 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6581 1.8797 -0.7461 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 0.7827 -2.0339 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4056 1.1351 0.7276 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9808 2.4088 -0.9196 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 56 1 0 56 57 1 0 56 55 1 0 55 53 1 0 53 54 1 6 53 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 1 27 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 1 0 35 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 35 36 1 0 36 38 1 0 36 37 2 0 31 45 1 0 45 46 1 6 45 47 1 0 45 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 1 23 21 1 0 21 22 1 0 6 7 1 1 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 12 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 22 2 1 0 19 10 1 0 21 6 1 0 51 53 1 0 51 26 1 0 48 27 1 0 43 33 1 0 1 58 1 0 1 59 1 0 1 60 1 0 3 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 56122 1 1 57123 1 0 55120 1 0 55121 1 0 54117 1 0 54118 1 0 54119 1 0 24 82 1 0 25 83 1 0 25 84 1 0 26 85 1 6 28 86 1 0 28 87 1 0 28 88 1 0 29 89 1 0 29 90 1 0 30 91 1 0 30 92 1 0 31 93 1 6 33 94 1 6 35 95 1 1 39 97 1 1 40 98 1 0 41 99 1 6 42100 1 0 43101 1 1 44102 1 0 38 96 1 0 46103 1 0 46104 1 0 46105 1 0 47106 1 0 47107 1 0 47108 1 0 48109 1 6 49110 1 0 49111 1 0 50112 1 0 50113 1 0 52114 1 0 52115 1 0 52116 1 0 21 79 1 1 22 80 1 0 22 81 1 0 10 68 1 1 12 69 1 6 13 70 1 0 13 71 1 0 14 72 1 0 15 73 1 6 16 74 1 0 17 75 1 1 18 76 1 0 19 77 1 1 20 78 1 0 M END