@MOLECULE 3-[(3e)-4-(4-hydroxyphenyl)-3-hexen-3-yl]phenol 40 41 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.8784 0.4122 1.6387 O.3 1 UNL1111111111 -0.4749 2 O 5.8828 -0.2043 0.2779 O.3 1 UNL1111111111 -0.4749 3 C -0.4812 -0.5586 -0.2520 C.2 1 UNL1111111111 -0.0585 4 C 0.3781 0.4625 -0.3892 C.2 1 UNL1111111111 -0.0225 5 C -0.0562 -1.9646 0.0499 C.3 1 UNL1111111111 -0.2521 6 C -0.0553 1.8646 -0.7031 C.3 1 UNL1111111111 -0.2586 7 C -1.9351 -0.3759 -0.3830 C.ar 1 UNL1111111111 0.0952 8 C 1.8284 0.2824 -0.2380 C.ar 1 UNL1111111111 -0.0659 9 C -0.0594 -2.2145 1.5600 C.3 1 UNL1111111111 -0.4253 10 C -0.2932 2.6537 0.5868 C.3 1 UNL1111111111 -0.4252 11 C -2.6905 -0.0608 0.7482 C.ar 1 UNL1111111111 -0.3310 12 C 2.6104 -0.0318 -1.3506 C.ar 1 UNL1111111111 -0.0892 13 C 2.4190 0.4310 1.0223 C.ar 1 UNL1111111111 -0.0919 14 C -2.5521 -0.5255 -1.6276 C.ar 1 UNL1111111111 -0.2494 15 C -4.0664 0.1013 0.5936 C.ar 1 UNL1111111111 0.3001 16 C 3.9862 -0.2041 -1.2170 C.ar 1 UNL1111111111 -0.3042 17 C 3.7884 0.2655 1.1791 C.ar 1 UNL1111111111 -0.2427 18 C -3.9317 -0.3564 -1.7497 C.ar 1 UNL1111111111 -0.0689 19 C 4.5507 -0.0527 0.0494 C.ar 1 UNL1111111111 0.2836 20 C -4.7082 -0.0399 -0.6411 C.ar 1 UNL1111111111 -0.2633 21 H -0.7280 -2.6882 -0.4559 H 1 UNL1111111111 0.1477 22 H 0.9561 -2.1627 -0.3616 H 1 UNL1111111111 0.1518 23 H -0.9802 1.8610 -1.3175 H 1 UNL1111111111 0.1516 24 H 0.7105 2.3745 -1.3229 H 1 UNL1111111111 0.1480 25 H 0.6232 -1.5279 2.0750 H 1 UNL1111111111 0.1466 26 H 0.2608 -3.2363 1.7913 H 1 UNL1111111111 0.1436 27 H -1.0600 -2.0742 1.9845 H 1 UNL1111111111 0.1443 28 H -0.6061 3.6806 0.3689 H 1 UNL1111111111 0.1434 29 H 0.6163 2.7040 1.1965 H 1 UNL1111111111 0.1459 30 H -1.0790 2.1889 1.1939 H 1 UNL1111111111 0.1450 31 H -2.2120 0.0540 1.7140 H 1 UNL1111111111 0.1661 32 H 2.1405 -0.1442 -2.3270 H 1 UNL1111111111 0.1561 33 H 1.7963 0.6768 1.8821 H 1 UNL1111111111 0.1567 34 H -1.9530 -0.7727 -2.4998 H 1 UNL1111111111 0.1611 35 H 4.5977 -0.4495 -2.0781 H 1 UNL1111111111 0.1599 36 H 4.2721 0.3749 2.1459 H 1 UNL1111111111 0.1754 37 H -4.4055 -0.4733 -2.7244 H 1 UNL1111111111 0.1497 38 H -5.7829 0.0972 -0.7133 H 1 UNL1111111111 0.1749 39 H -4.3787 0.5013 2.4853 H 1 UNL1111111111 0.3261 40 H 6.3794 -0.4251 -0.5449 H 1 UNL1111111111 0.3256 @BOND 1 1 15 1 2 1 39 1 3 2 19 1 4 2 40 1 5 3 4 2 6 3 5 1 7 3 7 1 8 4 6 1 9 4 8 1 10 5 9 1 11 5 21 1 12 5 22 1 13 6 10 1 14 6 23 1 15 6 24 1 16 7 11 ar 17 7 14 ar 18 8 12 ar 19 8 13 ar 20 9 25 1 21 9 26 1 22 9 27 1 23 10 28 1 24 10 29 1 25 10 30 1 26 11 15 ar 27 11 31 1 28 12 16 ar 29 12 32 1 30 13 17 ar 31 13 33 1 32 14 18 ar 33 14 34 1 34 15 20 ar 35 16 19 ar 36 16 35 1 37 17 19 ar 38 17 36 1 39 18 20 ar 40 18 37 1 41 20 38 1