RDKit 3D 81 85 0 0 0 0 0 0 0 0999 V2000 4.9164 1.1159 -1.9353 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7644 0.1305 -0.8169 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1615 0.7945 0.4250 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9320 1.2877 0.0776 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 0.4432 0.5162 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8430 0.6466 2.0211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1164 0.1290 2.6108 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1937 -0.1248 1.5963 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5295 0.1167 2.3146 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5895 0.9403 -0.0208 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5161 0.7163 -1.5176 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9722 -0.7030 -1.7743 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1443 -1.4778 -0.4707 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3873 -2.9250 -0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6543 -3.8372 0.1782 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5326 -4.3848 -0.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8007 -5.8135 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5694 -3.5900 -0.6896 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7589 -3.2272 0.1011 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6526 -3.8571 1.4973 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -1.7398 0.3488 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8376 -1.5606 1.2875 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0316 -0.9472 -0.9043 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8954 0.0216 -1.0522 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0688 1.3167 -0.3882 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1096 1.5640 0.5527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9888 2.7976 0.9475 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9739 3.3738 0.3515 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4671 4.6544 0.4353 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1003 5.5414 1.3112 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3785 5.0187 -0.3255 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8508 6.4238 -0.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7691 4.1347 -1.1793 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2726 2.8109 -1.2754 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3549 2.4644 -0.5117 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5198 2.0284 -2.2527 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6004 2.4968 -3.4944 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7539 0.8971 -2.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2356 -0.8248 0.1571 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0358 1.1105 -2.6266 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9672 2.1324 -1.5148 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 0.8530 -2.5383 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7592 -0.3026 -0.5538 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1508 -0.7099 -1.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8231 1.6924 0.6078 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8359 1.7657 2.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9301 0.2679 2.4822 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9037 -0.8344 3.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4913 0.8190 3.4155 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2314 -1.2144 1.3069 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3678 -0.0606 1.6399 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5149 -0.5457 3.2023 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 1.1643 2.6904 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3056 0.5282 0.4372 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5202 2.0740 0.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3001 1.3481 -2.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1573 -1.1849 -2.3418 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9221 -0.7489 -2.3596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3177 -1.2882 0.2345 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1923 -3.1288 -1.7976 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4952 -3.1023 -0.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1456 -4.1134 1.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0174 -6.5067 0.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7278 -6.1125 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8279 -5.9132 1.5013 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -2.6517 -1.0476 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8553 -4.2408 -1.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7052 -3.5960 -0.3493 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -3.6987 1.9195 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3344 -3.3034 2.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9998 -4.8951 1.5145 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8806 -1.3746 0.8073 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6782 -1.9034 0.8806 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4258 -1.2231 -1.7483 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6918 -0.1550 -1.8377 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8875 0.8580 0.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7835 6.4978 1.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9019 6.5119 -0.7381 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5918 7.0588 -0.7692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8343 6.7632 0.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 4.5110 -1.7569 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 5 4 1 6 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 5 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 29 31 1 0 31 32 1 0 31 33 2 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 2 0 36 38 1 0 13 39 1 0 8 3 1 0 38 11 1 0 39 5 1 0 35 25 1 0 35 28 1 0 1 40 1 0 1 41 1 0 1 42 1 0 2 43 1 0 2 44 1 0 3 45 1 1 6 46 1 0 6 47 1 0 7 48 1 0 7 49 1 0 8 50 1 6 9 51 1 0 9 52 1 0 9 53 1 0 10 54 1 0 10 55 1 0 11 56 1 6 12 57 1 0 12 58 1 0 13 59 1 1 14 60 1 0 14 61 1 0 15 62 1 0 17 63 1 0 17 64 1 0 17 65 1 0 18 66 1 0 18 67 1 0 19 68 1 6 20 69 1 0 20 70 1 0 20 71 1 0 21 72 1 1 22 73 1 0 23 74 1 0 24 75 1 0 26 76 1 0 30 77 1 0 32 78 1 0 32 79 1 0 32 80 1 0 33 81 1 0 M END