@MOLECULE 3-aminooxy-1-propanamine 16 15 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 1.7106 0.5025 0.0032 O.3 1 UNL1 -0.2467 2 N -3.1279 0.2018 -0.0085 N.3 1 UNL1 -0.6359 3 N 2.9441 -0.1900 -0.0081 N.4 1 UNL1 -0.4381 4 C -0.6104 0.3789 0.0083 C.3 1 UNL1 -0.3611 5 C -1.8520 -0.5333 0.0030 C.3 1 UNL1 -0.0940 6 C 0.6563 -0.4759 0.0047 C.3 1 UNL1 -0.0511 7 H -0.6158 1.0511 -0.8700 H 1 UNL1 0.1529 8 H -0.6176 1.0428 0.8931 H 1 UNL1 0.1529 9 H -1.8467 -1.1979 0.8962 H 1 UNL1 0.1441 10 H -1.8342 -1.2038 -0.8850 H 1 UNL1 0.1439 11 H 0.7414 -1.1078 -0.8953 H 1 UNL1 0.1330 12 H 0.7493 -1.1103 0.9020 H 1 UNL1 0.1331 13 H -3.2292 0.7724 -0.8315 H 1 UNL1 0.2475 14 H -3.2378 0.7831 0.8055 H 1 UNL1 0.2475 15 H 3.4150 0.1724 0.8091 H 1 UNL1 0.2361 16 H 3.3994 0.1692 -0.8349 H 1 UNL1 0.2358 @BOND 1 11 6 1 2 10 5 1 3 7 4 1 4 16 3 1 5 13 2 1 6 2 5 1 7 2 14 1 8 3 1 1 9 3 15 1 10 5 4 1 11 5 9 1 12 1 6 1 13 6 4 1 14 6 12 1 15 4 8 1