@MOLECULE 4,4'-(1e,3s)-penta-1,4-diene-1,3-diyldiphenol 35 36 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.2585 -2.4301 0.0011 O.3 1 UNL1111111111 -0.4737 2 O 6.1574 -1.3552 0.3512 O.3 1 UNL1111111111 -0.4741 3 C -1.2036 1.4776 -0.1187 C.3 1 UNL1111111111 -0.1325 4 C -2.2898 0.4313 -0.0879 C.ar 1 UNL1111111111 -0.0602 5 C 0.1252 0.8430 0.1819 C.2 1 UNL1111111111 -0.1398 6 C -2.5584 -0.3004 1.0752 C.ar 1 UNL1111111111 -0.0993 7 C -3.0339 0.1941 -1.2450 C.ar 1 UNL1111111111 -0.0944 8 C -1.4934 2.5426 0.9058 C.2 1 UNL1111111111 -0.1074 9 C 1.1465 0.8774 -0.6813 C.2 1 UNL1111111111 -0.1679 10 C 2.4418 0.2624 -0.3998 C.ar 1 UNL1111111111 -0.0720 11 C -3.5609 -1.2609 1.0903 C.ar 1 UNL1111111111 -0.2377 12 C -4.0453 -0.7630 -1.2563 C.ar 1 UNL1111111111 -0.3002 13 C -4.2922 -1.4763 -0.0833 C.ar 1 UNL1111111111 0.2821 14 C 2.5200 -1.0108 0.1712 C.ar 1 UNL1111111111 -0.0778 15 C 3.6169 0.9602 -0.7152 C.ar 1 UNL1111111111 -0.0911 16 C 3.7564 -1.5940 0.4377 C.ar 1 UNL1111111111 -0.3087 17 C 4.8600 0.4028 -0.4537 C.ar 1 UNL1111111111 -0.2432 18 C -1.8167 3.7913 0.5745 C.2 1 UNL1111111111 -0.3284 19 C 4.9078 -0.8724 0.1223 C.ar 1 UNL1111111111 0.2878 20 H -1.1725 1.9459 -1.1406 H 1 UNL1111111111 0.1558 21 H 0.2005 0.3555 1.1519 H 1 UNL1111111111 0.1517 22 H -1.9780 -0.1160 1.9790 H 1 UNL1111111111 0.1543 23 H -2.8269 0.7601 -2.1529 H 1 UNL1111111111 0.1513 24 H -1.4229 2.2164 1.9420 H 1 UNL1111111111 0.1447 25 H 1.0708 1.3802 -1.6468 H 1 UNL1111111111 0.1543 26 H -3.7862 -1.8389 1.9826 H 1 UNL1111111111 0.1750 27 H -4.6234 -0.9452 -2.1550 H 1 UNL1111111111 0.1603 28 H 1.6047 -1.5562 0.4027 H 1 UNL1111111111 0.1568 29 H 3.5512 1.9519 -1.1630 H 1 UNL1111111111 0.1545 30 H 3.8173 -2.5827 0.8777 H 1 UNL1111111111 0.1605 31 H 5.7836 0.9275 -0.6839 H 1 UNL1111111111 0.1753 32 H -2.0309 4.5608 1.3000 H 1 UNL1111111111 0.1465 33 H -1.8968 4.1469 -0.4404 H 1 UNL1111111111 0.1447 34 H -5.7380 -2.5478 -0.8535 H 1 UNL1111111111 0.3261 35 H 6.1416 -2.2549 0.7566 H 1 UNL1111111111 0.3266 @BOND 1 1 13 1 2 1 34 1 3 2 19 1 4 2 35 1 5 3 4 1 6 3 5 1 7 3 8 1 8 3 20 1 9 4 6 ar 10 4 7 ar 11 5 9 2 12 5 21 1 13 6 11 ar 14 6 22 1 15 7 12 ar 16 7 23 1 17 8 18 2 18 8 24 1 19 9 10 1 20 9 25 1 21 10 14 ar 22 10 15 ar 23 11 13 ar 24 11 26 1 25 12 13 ar 26 12 27 1 27 14 16 ar 28 14 28 1 29 15 17 ar 30 15 29 1 31 16 19 ar 32 16 30 1 33 17 19 ar 34 17 31 1 35 18 32 1 36 18 33 1