@MOLECULE n-hydroxy-n-methylcyclohexanamine 24 24 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 2.6240 0.6991 -0.6793 C.3 1 UNL1 -0.3042 2 N 1.7125 -0.3928 -0.2753 N.4 1 UNL1 -0.2203 3 O 1.8869 -0.5069 1.1334 O.3 1 UNL1 -0.3890 4 C 0.2793 -0.0556 -0.4921 C.3 1 UNL1 0.0248 5 C -0.5496 -1.3141 -0.1544 C.3 1 UNL1 -0.2803 6 C -2.0317 -1.0612 -0.4489 C.3 1 UNL1 -0.2659 7 C -2.5442 0.1429 0.3522 C.3 1 UNL1 -0.2637 8 C -1.7131 1.3939 0.0382 C.3 1 UNL1 -0.2624 9 C -0.2297 1.1448 0.3307 C.3 1 UNL1 -0.3071 10 H 3.6619 0.3463 -0.5475 H 1 UNL1 0.1561 11 H 2.4706 0.9235 -1.7455 H 1 UNL1 0.1484 12 H 2.5106 1.6239 -0.0939 H 1 UNL1 0.1404 13 H 2.2029 -1.4455 1.2311 H 1 UNL1 0.2985 14 H 0.1737 0.1684 -1.5853 H 1 UNL1 0.1379 15 H -0.1771 -2.1757 -0.7384 H 1 UNL1 0.1421 16 H -0.4089 -1.5801 0.9099 H 1 UNL1 0.1491 17 H -2.1803 -0.8866 -1.5306 H 1 UNL1 0.1344 18 H -2.6233 -1.9617 -0.2012 H 1 UNL1 0.1329 19 H -3.6097 0.3265 0.1247 H 1 UNL1 0.1305 20 H -2.4942 -0.0773 1.4352 H 1 UNL1 0.1391 21 H -1.8487 1.6822 -1.0206 H 1 UNL1 0.1337 22 H -2.0766 2.2492 0.6375 H 1 UNL1 0.1335 23 H -0.0788 0.9444 1.4093 H 1 UNL1 0.1585 24 H 0.3606 2.0492 0.1042 H 1 UNL1 0.1329 @BOND 1 11 1 1 2 14 4 1 3 17 6 1 4 21 8 1 5 15 5 1 6 1 10 1 7 1 2 1 8 1 12 1 9 4 2 1 10 4 5 1 11 4 9 1 12 6 18 1 13 6 5 1 14 6 7 1 15 2 3 1 16 5 16 1 17 8 9 1 18 8 7 1 19 8 22 1 20 24 9 1 21 19 7 1 22 9 23 1 23 7 20 1 24 3 13 1