@MOLECULE 4-aminooxybutylamine 19 18 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.3449 -0.4619 -0.0228 O.3 1 UNL1 -0.2464 2 N -3.7757 0.2246 0.0043 N.3 1 UNL1 -0.6396 3 N 3.5499 0.2767 0.0216 N.4 1 UNL1 -0.4400 4 C -1.2554 0.4030 -0.0114 C.3 1 UNL1 -0.3205 5 C 0.0211 -0.4389 0.0074 C.3 1 UNL1 -0.3003 6 C -2.4987 -0.5108 0.0045 C.3 1 UNL1 -0.0987 7 C 1.2512 0.4724 -0.0014 C.3 1 UNL1 -0.0553 8 H -1.2762 1.0853 0.8584 H 1 UNL1 0.1411 9 H -1.2730 1.0488 -0.9089 H 1 UNL1 0.1411 10 H 0.0524 -1.1206 -0.8650 H 1 UNL1 0.1523 11 H 0.0450 -1.0947 0.8997 H 1 UNL1 0.1521 12 H -2.4817 -1.1706 0.9001 H 1 UNL1 0.1437 13 H -2.4919 -1.1860 -0.8799 H 1 UNL1 0.1439 14 H 1.3030 1.1120 -0.8976 H 1 UNL1 0.1304 15 H 1.3227 1.1043 0.8988 H 1 UNL1 0.1333 16 H -3.8809 0.8010 -0.8135 H 1 UNL1 0.2459 17 H -3.8818 0.8002 0.8224 H 1 UNL1 0.2458 18 H 4.0264 -0.0099 -0.8219 H 1 UNL1 0.2351 19 H 4.0277 -0.1177 0.8195 H 1 UNL1 0.2360 @BOND 1 9 4 1 2 14 7 1 3 13 6 1 4 10 5 1 5 18 3 1 6 16 2 1 7 1 7 1 8 1 3 1 9 4 6 1 10 4 5 1 11 4 8 1 12 7 5 1 13 7 15 1 14 2 6 1 15 2 17 1 16 6 12 1 17 5 11 1 18 3 19 1