RDKit 3D 42 45 0 0 0 0 0 0 0 0999 V2000 4.4920 0.8057 1.0927 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6343 0.4260 0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7637 0.2911 -1.2578 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8732 0.2901 -1.8784 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4744 0.1664 -1.8249 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6366 0.7054 -0.7936 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1903 -0.0047 0.4041 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2654 -1.4926 0.2458 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0008 -2.2232 0.1715 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2363 -1.4621 0.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2593 -2.1264 1.1785 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5778 -0.2801 -0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8939 0.3380 0.1372 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9594 -0.1768 -0.6237 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1201 -0.6241 -0.0268 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2774 -1.1779 -0.7792 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1751 -0.5474 1.2236 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7002 1.8225 -0.1231 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5683 2.2502 -1.4404 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4237 1.9738 -0.6907 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4434 3.1447 -0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2133 0.6509 -1.0274 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1946 0.8367 2.1254 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4826 1.0852 0.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9879 1.7769 -0.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8126 0.3401 1.3633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9287 -1.8610 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8693 -1.6897 -0.6755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9022 -2.7697 -0.8155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0163 -3.0409 0.9222 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7122 -1.5148 1.9521 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -3.0526 1.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -2.5612 0.5482 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1803 0.2757 1.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8601 -1.8420 -0.1209 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9549 -0.3697 -1.1422 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9548 -1.7626 -1.6687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1555 2.5378 0.5524 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 3.5099 -1.1483 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 3.9742 -0.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0228 2.9723 0.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0008 0.4057 -2.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 16 15 1 0 15 17 2 0 15 14 1 0 14 13 1 0 13 18 1 0 18 19 1 0 19 20 1 0 20 21 1 1 20 22 1 0 22 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 2 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 20 18 1 0 12 22 1 0 7 6 1 0 16 35 1 0 16 36 1 0 16 37 1 0 13 34 1 1 18 38 1 1 21 39 1 0 21 40 1 0 21 41 1 0 22 42 1 6 6 25 1 1 1 23 1 0 1 24 1 0 7 26 1 1 8 27 1 0 8 28 1 0 9 29 1 0 9 30 1 0 11 31 1 0 11 32 1 0 11 33 1 0 M END