HMDB0303097 RDKit 3D 4-Phenylbenzaldehyde 24 25 0 0 0 0 0 0 0 0999 V2000 5.2443 0.4100 0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4474 -0.5680 0.2439 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9943 -0.3690 0.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5093 0.9039 -0.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1292 1.0774 -0.1985 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2452 0.0224 -0.1099 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2002 0.1706 -0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 1.1494 -1.0231 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1403 1.2694 -1.1136 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 0.4245 -0.4124 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4343 -0.5571 0.3927 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0626 -0.6571 0.4666 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7911 -1.2270 0.0986 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1452 -1.4402 0.2164 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8666 -1.5443 0.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1903 1.7473 -0.1547 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7484 2.0574 -0.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0943 1.8110 -1.5728 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5814 2.0445 -1.7494 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 0.4863 -0.4563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0579 -1.2475 0.9651 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -1.4203 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1532 -2.0962 0.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5205 -2.4474 0.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 6 13 1 0 13 14 2 0 14 3 1 0 12 7 1 0 2 15 1 0 4 16 1 0 5 17 1 0 8 18 1 0 9 19 1 0 10 20 1 0 11 21 1 0 12 22 1 0 13 23 1 0 14 24 1 0 M END