@MOLECULE 1-(3-chloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone 35 35 0 0 0 SMALL GASTEIGER @ATOM 1 CL -2.1262 -1.9791 -0.9329 Cl 1 UNL111111111 -0.0373 2 O 1.9847 2.7553 -0.3385 O.2 1 UNL111111111 -0.5528 3 O 0.4567 -0.7185 -1.7426 O.3 1 UNL111111111 -0.4524 4 O -0.0843 3.0645 1.0636 O.3 1 UNL111111111 -0.4570 5 O -3.3767 -0.2520 1.0977 O.3 1 UNL111111111 -0.3411 6 C 3.4755 -0.0290 -0.2964 C.3 1 UNL111111111 -0.2493 7 C 2.6491 -1.1804 0.2862 C.3 1 UNL111111111 -0.2727 8 C 2.6948 0.7738 -1.3486 C.3 1 UNL111111111 -0.3633 9 C 3.4676 -1.9861 1.3027 C.3 1 UNL111111111 -0.2512 10 C 1.6555 1.6184 -0.6650 C.2 1 UNL111111111 0.5692 11 C 0.3154 1.1377 -0.3253 C.ar 1 UNL111111111 -0.4611 12 C 2.6190 -3.1066 1.9041 C.3 1 UNL111111111 -0.4386 13 C -0.2557 -0.0527 -0.8175 C.ar 1 UNL111111111 0.4211 14 C -0.4739 1.8921 0.5838 C.ar 1 UNL111111111 0.4607 15 C -1.4991 -0.5044 -0.3761 C.ar 1 UNL111111111 -0.3474 16 C -1.7289 1.4474 1.0413 C.ar 1 UNL111111111 -0.4120 17 C -2.2205 0.2467 0.5632 C.ar 1 UNL111111111 0.3700 18 C -4.5270 0.0261 0.3011 C.3 1 UNL111111111 -0.1838 19 H 3.8172 0.6451 0.5144 H 1 UNL111111111 0.1482 20 H 4.3987 -0.4289 -0.7598 H 1 UNL111111111 0.1417 21 H 1.7362 -0.7878 0.7739 H 1 UNL111111111 0.1442 22 H 2.2958 -1.8435 -0.5256 H 1 UNL111111111 0.1407 23 H 3.3981 1.4433 -1.8943 H 1 UNL111111111 0.1715 24 H 2.2747 0.1086 -2.1252 H 1 UNL111111111 0.1809 25 H 4.3676 -2.4091 0.8193 H 1 UNL111111111 0.1307 26 H 3.8379 -1.3207 2.1055 H 1 UNL111111111 0.1359 27 H 1.7387 -2.7075 2.4221 H 1 UNL111111111 0.1475 28 H 2.2608 -3.7971 1.1329 H 1 UNL111111111 0.1405 29 H 3.1911 -3.6926 2.6315 H 1 UNL111111111 0.1396 30 H -2.2853 2.0416 1.7629 H 1 UNL111111111 0.2066 31 H 0.0191 -1.5542 -2.0646 H 1 UNL111111111 0.3485 32 H 0.8350 3.3458 0.6655 H 1 UNL111111111 0.3944 33 H -4.4263 -0.3760 -0.7108 H 1 UNL111111111 0.1373 34 H -4.7171 1.1044 0.2823 H 1 UNL111111111 0.1350 35 H -5.3192 -0.5027 0.8481 H 1 UNL111111111 0.1556 @BOND 1 1 15 1 2 2 10 2 3 3 13 1 4 3 31 1 5 4 14 1 6 4 32 1 7 5 17 1 8 5 18 1 9 6 7 1 10 6 8 1 11 6 19 1 12 6 20 1 13 7 9 1 14 7 21 1 15 7 22 1 16 8 10 1 17 8 23 1 18 8 24 1 19 9 12 1 20 9 25 1 21 9 26 1 22 10 11 1 23 11 13 ar 24 11 14 ar 25 12 27 1 26 12 28 1 27 12 29 1 28 13 15 ar 29 14 16 ar 30 15 17 ar 31 16 17 ar 32 16 30 1 33 18 33 1 34 18 34 1 35 18 35 1