RDKit 3D 96101 0 0 0 0 0 0 0 0999 V2000 5.4995 -0.6758 3.4877 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 0.3866 2.7374 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1719 1.5191 2.5427 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5545 -0.0991 2.3116 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7504 0.8346 1.5737 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2605 0.9969 0.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1002 0.5404 -0.7888 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3365 1.0072 -2.2500 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8294 2.3960 -2.6258 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8248 -0.0150 -3.2470 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4559 -0.0979 -4.6098 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5887 -1.2805 -3.6671 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9567 -1.5509 -3.0791 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -2.5297 -3.9543 C 0 0 2 0 0 0 0 0 0 0 0 0 1.3314 -3.1981 -2.6279 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3899 -3.5433 -4.9341 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4715 -4.7376 -5.2312 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7858 -2.8966 -6.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8252 0.8452 0.0755 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4946 2.3547 0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 0.2601 1.4171 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3752 0.4883 2.5962 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0217 -0.1435 2.2906 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5129 0.0202 0.8133 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4069 -1.0856 0.5841 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4316 0.0405 -0.3152 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9867 0.6666 -1.5063 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8156 -0.0635 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2648 0.7450 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1622 -1.2131 -2.0642 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 0.3329 3.3790 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4436 1.8371 3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -0.4277 3.2726 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -1.8563 3.8143 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9551 -1.8913 5.2892 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0553 -2.2952 6.1044 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4543 -0.5362 5.7984 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5265 0.0784 4.7912 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7087 1.1526 5.3034 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0425 -0.0814 5.0339 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9443 -0.0697 3.9222 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3945 -1.4131 3.7498 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9222 -0.9821 4.3637 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 -1.5297 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4605 -0.2770 3.8248 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7208 1.7999 2.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1633 0.4076 -0.0646 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5066 2.0494 -0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1854 -0.5574 -0.8219 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4246 1.0662 -2.3804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1547 3.1523 -1.9062 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7411 2.4209 -2.7251 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2294 2.6920 -3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7457 -0.0830 -3.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7904 -0.1748 -5.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3389 0.4979 -4.8169 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5179 -2.2629 -3.6902 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8695 -1.9595 -2.0679 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5723 -0.6482 -3.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7899 -2.1890 -4.4221 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1821 -3.7165 -2.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5261 -3.9249 -2.7708 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9703 -2.4602 -1.9071 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3015 -3.9464 -4.4764 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9222 -5.4004 -5.9783 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2984 -5.3425 -4.3363 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5016 -4.4054 -5.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9233 -2.4274 -6.7514 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5623 -2.1386 -6.1298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1928 -3.6441 -6.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3649 2.9561 0.4716 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 2.5493 0.9419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0941 2.7676 -0.7332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4285 -0.8315 1.2969 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2612 1.5657 2.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8974 -1.2268 2.4397 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1197 0.9231 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4487 -1.2928 -0.3722 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1482 -0.9892 -0.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3975 1.0909 -4.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8635 1.5930 -3.1296 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8791 0.1205 -4.1257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0766 2.1715 4.0575 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 2.0364 2.3041 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5627 2.4839 3.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2212 0.1060 3.8538 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8466 -0.4224 2.2529 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3625 -2.3389 3.6812 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6718 -2.4334 3.2173 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1673 -2.6441 5.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3361 -3.1743 5.7966 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2959 0.1398 5.9976 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9672 -0.6750 6.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3046 -0.6501 5.8875 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8056 0.5273 4.2433 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2494 -1.3662 3.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 7 8 1 0 40 41 1 0 41 22 1 0 8 9 1 0 34 35 1 0 8 10 1 0 21 5 1 0 10 12 1 0 5 6 1 0 12 14 1 0 23 24 1 0 14 16 1 0 34 33 1 0 16 17 1 0 35 37 1 0 16 18 1 0 37 38 1 0 31 33 1 0 22 21 1 0 14 15 1 0 26 27 1 0 19 26 1 0 10 11 1 0 12 11 1 0 26 24 1 0 12 13 1 1 31 38 1 0 35 36 1 0 6 7 1 0 31 32 1 1 7 19 1 0 27 28 1 0 24 25 1 0 28 29 1 0 23 22 1 0 28 30 2 0 38 39 1 1 40 39 1 0 41 42 1 0 19 21 1 0 5 4 1 0 31 23 1 0 4 2 1 0 19 20 1 1 2 1 1 0 38 40 1 0 2 3 2 0 21 74 1 6 5 46 1 1 6 47 1 0 6 48 1 0 7 49 1 6 23 76 1 1 22 75 1 1 26 79 1 6 24 77 1 1 40 94 1 1 41 95 1 1 34 88 1 0 34 89 1 0 35 90 1 6 37 92 1 0 37 93 1 0 33 86 1 0 33 87 1 0 36 91 1 0 32 83 1 0 32 84 1 0 32 85 1 0 25 78 1 0 20 71 1 0 20 72 1 0 20 73 1 0 8 50 1 1 9 51 1 0 9 52 1 0 9 53 1 0 10 54 1 6 14 60 1 6 16 64 1 1 17 65 1 0 17 66 1 0 17 67 1 0 18 68 1 0 18 69 1 0 18 70 1 0 15 61 1 0 15 62 1 0 15 63 1 0 11 55 1 0 11 56 1 0 13 57 1 0 13 58 1 0 13 59 1 0 29 80 1 0 29 81 1 0 29 82 1 0 42 96 1 0 1 43 1 0 1 44 1 0 1 45 1 0 M END