@MOLECULE 3-[(2-hydroxyethyl)(nitroso)amino]-1,2-propanediol 23 22 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.2081 -0.9269 1.4588 O.3 1 UNL1111111111 -0.5619 2 O 2.5107 -1.2346 -1.3635 O.3 1 UNL1111111111 -0.5648 3 O -3.0897 -1.8518 -0.1854 O.3 1 UNL1111111111 -0.5497 4 O 0.0408 2.6240 -0.5543 O.2 1 UNL1111111111 -0.3087 5 N -0.7727 0.8844 0.4280 N.pl3 1 UNL1111111111 -0.3512 6 N -0.9139 1.9167 -0.3911 N.2 1 UNL1111111111 0.2093 7 C 0.4588 0.5737 1.1631 C.3 1 UNL1111111111 -0.1598 8 C 1.2674 -0.5457 0.4733 C.3 1 UNL1111111111 0.1222 9 C -1.9388 0.0072 0.5986 C.3 1 UNL1111111111 -0.0855 10 C 2.0059 -0.0444 -0.7766 C.3 1 UNL1111111111 -0.0634 11 C -2.0867 -0.9447 -0.6098 C.3 1 UNL1111111111 -0.0222 12 H 1.0851 1.4918 1.2661 H 1 UNL1111111111 0.1785 13 H 0.2175 0.2579 2.2053 H 1 UNL1111111111 0.1725 14 H 0.6415 -1.4360 0.2380 H 1 UNL1111111111 0.1395 15 H -2.8657 0.6181 0.7084 H 1 UNL1111111111 0.1683 16 H -1.8414 -0.5885 1.5355 H 1 UNL1111111111 0.1679 17 H 2.8468 0.6228 -0.5169 H 1 UNL1111111111 0.1373 18 H 1.3312 0.4614 -1.4884 H 1 UNL1111111111 0.1356 19 H -1.1581 -1.5028 -0.8225 H 1 UNL1111111111 0.1256 20 H -2.4199 -0.4094 -1.5153 H 1 UNL1111111111 0.1287 21 H 2.8747 -1.5295 1.0597 H 1 UNL1111111111 0.3393 22 H 3.0414 -1.0281 -2.1564 H 1 UNL1111111111 0.3227 23 H -3.3257 -2.4623 -0.9105 H 1 UNL1111111111 0.3199 @BOND 1 1 8 1 2 1 21 1 3 2 10 1 4 2 22 1 5 3 11 1 6 3 23 1 7 4 6 2 8 5 6 1 9 5 7 1 10 5 9 1 11 7 8 1 12 7 12 1 13 7 13 1 14 8 10 1 15 8 14 1 16 9 11 1 17 9 15 1 18 9 16 1 19 10 17 1 20 10 18 1 21 11 19 1 22 11 20 1