RDKit 3D 81 85 0 0 0 0 0 0 0 0999 V2000 -0.5969 4.4150 3.8995 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8062 4.0673 3.0859 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8379 3.6025 3.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5836 4.3809 1.7815 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6445 4.0660 0.8417 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3226 2.7477 0.1086 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3865 1.6701 1.0589 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8338 0.4780 0.6156 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9521 -0.2160 1.3629 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5233 0.2274 2.7041 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8426 0.3668 2.9923 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2631 0.7613 4.2647 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3209 1.0092 5.2548 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7719 1.4017 6.4796 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0374 0.8683 4.9958 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4566 0.4758 3.7216 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3277 -1.3883 0.9677 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 -1.8916 -0.2776 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0982 -3.0466 -0.6533 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1267 -3.6220 -1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4868 -4.7381 -2.4015 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3294 -5.4958 -1.5236 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5589 -4.8138 -1.2226 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3932 -4.6046 -2.3654 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6132 -3.8209 -1.8917 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -5.9435 -3.0050 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5652 -5.7726 -4.1977 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5208 -6.7188 -3.3796 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8910 -8.0266 -3.8552 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5938 -6.8701 -2.1738 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1970 -7.7808 -1.2373 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0464 -3.0290 -2.7753 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7387 -1.8811 -2.3955 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6272 -1.3694 -3.3024 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5116 -1.3070 -1.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2172 -0.0962 -0.7056 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0914 0.3829 -1.4242 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0489 2.7822 -0.5568 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6129 4.0640 -1.0110 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3251 3.8157 -2.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7706 5.0015 -1.3869 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2081 6.2636 -1.8262 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0538 7.1278 -2.4464 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 8.3454 -2.9027 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2543 6.9466 -2.5923 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7144 5.2122 -0.1783 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0699 5.3177 -0.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 4.1222 4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2743 3.8759 3.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4257 5.4937 3.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6041 3.9753 1.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1013 2.5926 -0.6464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5893 0.1704 2.2261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3218 0.8708 4.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0088 1.4867 7.0752 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7848 1.0673 5.7577 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5233 0.3749 3.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -3.4637 0.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8147 -5.6772 -0.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8655 -3.9765 -3.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3006 -2.8986 -1.3897 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -4.3976 -1.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2715 -3.5531 -2.7231 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3883 -6.5473 -2.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4454 -5.4544 -3.9281 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0002 -6.2165 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5661 -7.8576 -4.5435 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6513 -7.3295 -2.4939 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 -8.5291 -1.7878 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2296 -3.4648 -3.7546 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -0.5937 -2.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 4.5209 -0.2179 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1278 3.1282 -1.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7797 4.7425 -2.5528 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2111 3.3403 -3.0197 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3272 4.5579 -2.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 9.0021 -3.4491 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5004 8.0552 -3.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9208 8.8861 -2.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 6.1619 0.3192 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0904 5.9892 -1.3611 H 0 0 0 0 0 0 0 0 0 0 0 0 28 29 1 0 20 32 2 0 46 47 1 0 41 42 1 0 39 40 1 0 20 19 1 0 32 33 1 0 33 35 2 0 18 19 2 0 18 35 1 0 4 2 1 0 2 3 2 0 2 1 1 0 39 38 1 0 39 41 1 0 18 17 1 0 35 36 1 0 36 8 1 0 8 9 2 0 9 17 1 0 41 46 1 0 36 37 2 0 46 5 1 0 33 34 1 0 20 21 1 0 5 6 1 0 6 38 1 0 10 11 2 0 6 7 1 0 11 12 1 0 28 26 1 0 12 13 2 0 28 30 1 0 13 15 1 0 22 30 1 0 15 16 2 0 16 10 1 0 9 10 1 0 22 23 1 0 13 14 1 0 8 7 1 0 23 24 1 0 42 43 1 0 24 26 1 0 43 44 1 0 22 21 1 0 43 45 2 0 5 4 1 0 26 27 1 0 24 25 1 0 30 31 1 0 1 48 1 0 1 49 1 0 1 50 1 0 46 80 1 1 47 81 1 0 6 52 1 6 41 76 1 6 39 72 1 1 40 73 1 0 40 74 1 0 40 75 1 0 5 51 1 1 31 69 1 0 27 65 1 0 26 64 1 1 22 59 1 1 25 61 1 0 25 62 1 0 25 63 1 0 24 60 1 6 30 68 1 6 28 66 1 6 29 67 1 0 32 70 1 0 19 58 1 0 34 71 1 0 11 53 1 0 12 54 1 0 15 56 1 0 16 57 1 0 14 55 1 0 44 77 1 0 44 78 1 0 44 79 1 0 M END