RDKit 3D 102104 0 0 0 0 0 0 0 0999 V2000 14.0663 2.4892 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9812 1.0175 -0.4022 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1353 0.2442 0.5306 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6886 0.5092 0.5936 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2424 1.8766 0.9655 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7195 1.9671 1.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0372 1.6287 -0.2438 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5115 1.7425 -0.0682 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8611 1.3917 -1.3541 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0124 0.4060 -1.5626 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5546 -0.5386 -0.5301 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0252 -0.4459 -0.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6468 -1.4337 0.7026 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1633 -1.4733 0.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3778 -1.8949 -0.2314 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1004 -1.9188 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4027 -2.8661 1.1475 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -2.9384 1.4499 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1999 -3.5529 2.4941 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8557 -2.3876 0.6741 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2437 -2.4928 1.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9919 -1.7764 -0.1363 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5938 -2.5935 -1.3437 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4542 -1.9004 0.0963 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3907 -0.9630 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2598 0.4840 -0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4353 0.6728 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9935 1.9263 -1.7402 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2422 3.1558 -1.2988 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6947 4.2642 -2.0604 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 5.4622 -1.7289 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0283 3.5871 -0.0965 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2845 2.7466 0.0197 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.6725 2.4502 -1.3053 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0484 1.4418 0.7143 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.2727 1.5718 2.0048 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4079 0.8100 0.9446 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3720 -0.5749 1.4725 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7223 -1.5099 0.4719 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.5594 -1.6658 -0.7467 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3627 -2.8223 1.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1156 -3.2063 0.3404 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8355 2.8011 0.8419 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1600 2.7831 -0.3333 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5524 3.1096 -0.9569 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0287 0.5904 -0.3252 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7034 0.8494 -1.4788 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2835 -0.8580 0.2871 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5555 0.3596 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1626 0.1996 -0.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2373 -0.1880 1.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5986 2.6136 0.2029 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6574 2.1672 1.9443 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4809 2.9820 1.3858 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4167 1.2762 1.8617 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1983 0.5753 -0.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3439 2.3297 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2036 1.0823 0.7429 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2695 2.8214 0.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1248 2.0353 -2.2308 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6192 0.2851 -2.5911 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 -1.6074 -0.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9965 -0.3842 0.4456 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 0.5789 -0.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5789 -0.6935 -1.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9609 -2.4580 0.4154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1648 -1.1206 1.6126 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7927 -0.4442 1.2409 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0261 -2.0908 1.8665 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5828 -1.1842 -1.0622 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6503 -2.9062 -0.6046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5747 -2.2620 -0.9267 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5196 -0.9062 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1507 -2.7079 2.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -3.9010 0.7711 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5521 -3.5242 1.1072 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4702 -1.8918 1.9267 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5707 -0.7854 -0.0714 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2945 -3.6249 -1.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7819 -2.1016 -1.9195 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4802 -2.6692 -2.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0453 -0.1815 -1.6364 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3931 1.8788 -2.6441 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1133 4.0668 -2.9466 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4143 3.5833 0.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3391 4.6513 -0.2506 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1081 3.3010 0.4678 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6563 2.3028 -1.3689 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2042 1.7633 1.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6768 2.3626 2.6633 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2610 0.5723 2.4868 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9686 1.4414 1.6699 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9553 0.8331 0.0067 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4174 -0.9171 1.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9016 -0.6689 2.4711 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0615 -1.2805 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8311 -2.7260 -0.9731 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5225 -1.1127 -0.6926 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1500 -2.6948 2.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1474 -3.5974 0.9539 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4970 -3.9388 0.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4100 -3.6596 -0.6357 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 1 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 6 39 41 1 0 41 42 1 0 29 30 1 0 30 31 2 0 42 24 1 0 39 25 1 0 35 26 1 0 1 43 1 0 1 44 1 0 1 45 1 0 2 46 1 0 2 47 1 0 3 48 1 0 3 49 1 0 4 50 1 0 4 51 1 0 5 52 1 0 5 53 1 0 6 54 1 0 6 55 1 0 7 56 1 0 7 57 1 0 8 58 1 0 8 59 1 0 9 60 1 0 10 61 1 0 11 62 1 0 11 63 1 0 12 64 1 0 12 65 1 0 13 66 1 0 13 67 1 0 14 68 1 0 14 69 1 0 15 70 1 0 15 71 1 0 16 72 1 0 16 73 1 0 17 74 1 0 17 75 1 0 21 76 1 0 21 77 1 0 22 78 1 6 23 79 1 0 23 80 1 0 23 81 1 0 27 82 1 0 28 83 1 0 32 85 1 0 32 86 1 0 33 87 1 1 34 88 1 0 36 89 1 0 36 90 1 0 36 91 1 0 37 92 1 0 37 93 1 0 38 94 1 0 38 95 1 0 40 96 1 0 40 97 1 0 40 98 1 0 41 99 1 0 41100 1 0 42101 1 0 42102 1 0 30 84 1 0 M END