@MOLECULE 1,2,3-propanetriol 1,3-dinitrate 18 17 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.0281 -1.5608 1.0105 O.3 1 UNL11111111111 -0.5038 2 O 2.2932 -0.4142 -0.1800 O.2 1 UNL11111111111 -0.2691 3 O -2.2697 -0.3581 -0.3109 O.2 1 UNL11111111111 -0.2764 4 O 3.6136 1.3609 0.1317 O.2 1 UNL11111111111 -0.3809 5 O -3.6725 1.2441 0.3617 O.2 1 UNL11111111111 -0.3805 6 O 4.4054 -0.5208 -0.6585 O.2 1 UNL11111111111 -0.2837 7 O -4.3783 -0.4705 -0.8021 O.2 1 UNL11111111111 -0.2852 8 N 3.5529 0.2119 -0.2371 N.pl3 1 UNL11111111111 0.7072 9 N -3.5592 0.2006 -0.2364 N.pl3 1 UNL11111111111 0.7107 10 C -0.0019 -0.4654 0.1449 C.3 1 UNL11111111111 0.1275 11 C 1.2446 0.4203 0.3193 C.3 1 UNL11111111111 -0.1474 12 C -1.2632 0.3857 0.3819 C.3 1 UNL11111111111 -0.1422 13 H -0.0202 -0.9654 -0.8598 H 1 UNL11111111111 0.1893 14 H 1.4447 0.6703 1.3760 H 1 UNL11111111111 0.1519 15 H 1.1872 1.3545 -0.2695 H 1 UNL11111111111 0.1596 16 H -1.1909 1.4013 -0.0473 H 1 UNL11111111111 0.1553 17 H -1.5219 0.4617 1.4533 H 1 UNL11111111111 0.1560 18 H 0.1163 -1.2940 1.9496 H 1 UNL11111111111 0.3118 @BOND 1 1 10 1 2 1 18 1 3 2 8 1 4 2 11 1 5 3 9 1 6 3 12 1 7 4 8 2 8 5 9 2 9 6 8 2 10 7 9 2 11 10 11 1 12 10 12 1 13 10 13 1 14 11 14 1 15 11 15 1 16 12 16 1 17 12 17 1