@MOLECULE 2-butylaminoethanol 23 22 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.1394 0.2324 0.0501 O.3 1 UNL1111111111 -0.5596 2 N -0.5621 -0.3832 0.0350 N.3 1 UNL1111111111 -0.5507 3 C 1.8994 -0.3602 0.0395 C.3 1 UNL1111111111 -0.2880 4 C 0.6265 0.5002 -0.0363 C.3 1 UNL1111111111 -0.1091 5 C 3.1472 0.5206 -0.0923 C.3 1 UNL1111111111 -0.2511 6 C -1.8131 0.4012 0.1145 C.3 1 UNL1111111111 -0.1339 7 C 4.4185 -0.3201 0.0240 C.3 1 UNL1111111111 -0.4373 8 C -2.9826 -0.5631 -0.1647 C.3 1 UNL1111111111 -0.0009 9 H 1.8793 -1.1230 -0.7640 H 1 UNL1111111111 0.1546 10 H 1.9290 -0.9246 0.9885 H 1 UNL1111111111 0.1363 11 H 0.6368 1.2715 0.7625 H 1 UNL1111111111 0.1123 12 H 0.5897 1.0378 -1.0102 H 1 UNL1111111111 0.1431 13 H 3.1431 1.3079 0.6855 H 1 UNL1111111111 0.1338 14 H 3.1339 1.0532 -1.0631 H 1 UNL1111111111 0.1361 15 H -0.4882 -1.0252 0.8230 H 1 UNL1111111111 0.2515 16 H -1.8045 1.2009 -0.6575 H 1 UNL1111111111 0.1522 17 H -1.9656 0.9067 1.0918 H 1 UNL1111111111 0.1295 18 H 5.3158 0.3007 -0.0751 H 1 UNL1111111111 0.1413 19 H 4.4762 -0.8281 0.9941 H 1 UNL1111111111 0.1429 20 H 4.4631 -1.0903 -0.7539 H 1 UNL1111111111 0.1441 21 H -3.0023 -1.4120 0.5392 H 1 UNL1111111111 0.1144 22 H -2.9630 -0.9346 -1.2029 H 1 UNL1111111111 0.1247 23 H -4.9356 -0.2332 -0.2648 H 1 UNL1111111111 0.3137 @BOND 1 1 8 1 2 1 23 1 3 2 4 1 4 2 6 1 5 2 15 1 6 3 4 1 7 3 5 1 8 3 9 1 9 3 10 1 10 4 11 1 11 4 12 1 12 5 7 1 13 5 13 1 14 5 14 1 15 6 8 1 16 6 16 1 17 6 17 1 18 7 18 1 19 7 19 1 20 7 20 1 21 8 21 1 22 8 22 1