@MOLECULE bis(2,2,2-trinitroethyl)-amine 28 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.2865 -0.0206 0.2134 C.3 1 UNL111111111 1.7101 2 C -1.0764 -0.1789 1.1626 C.3 1 UNL111111111 -0.3617 3 N 0.0301 0.6461 0.6494 N.3 1 UNL111111111 -0.7587 4 C 1.3030 0.4162 1.3366 C.3 1 UNL111111111 -0.3804 5 C 2.3380 0.0382 0.2359 C.3 1 UNL111111111 1.5988 6 N -2.9297 1.3666 0.3189 N.pl3 1 UNL111111111 -0.4791 7 N -3.3654 -1.0491 0.5899 N.pl3 1 UNL111111111 -0.5020 8 N -1.8548 -0.2613 -1.2447 N.pl3 1 UNL111111111 -0.5137 9 N 3.6684 -0.3364 0.8940 N.pl3 1 UNL111111111 -0.5152 10 N 2.6073 1.2157 -0.7092 N.pl3 1 UNL111111111 -0.3336 11 N 1.8245 -1.1702 -0.5556 N.pl3 1 UNL111111111 -0.6130 12 O -4.0205 1.4915 -0.1785 O.2 1 UNL111111111 0.0256 13 O -2.2902 2.2118 0.9076 O.2 1 UNL111111111 -0.1004 14 O -3.4011 -1.3429 1.7654 O.2 1 UNL111111111 -0.0248 15 O -4.0696 -1.4562 -0.2961 O.2 1 UNL111111111 0.0466 16 O -1.6343 -1.4123 -1.5259 O.2 1 UNL111111111 0.0315 17 O -1.7625 0.7177 -1.9408 O.2 1 UNL111111111 -0.0313 18 O 3.9741 0.3388 1.8539 O.2 1 UNL111111111 -0.0454 19 O 4.2847 -1.2567 0.4190 O.2 1 UNL111111111 0.0817 20 O 2.0095 2.2390 -0.4688 O.2 1 UNL111111111 -0.1223 21 O 3.4110 1.0221 -1.5872 O.2 1 UNL111111111 -0.0231 22 O 1.7887 -1.0874 -1.7534 O.2 1 UNL111111111 0.0547 23 O 1.4832 -2.1039 0.1394 O.2 1 UNL111111111 0.0425 24 H -0.7579 -1.2566 1.1770 H 1 UNL111111111 0.1807 25 H -1.3860 0.0796 2.2053 H 1 UNL111111111 0.1865 26 H -0.2189 1.6413 0.6172 H 1 UNL111111111 0.4523 27 H 1.2574 -0.4057 2.0909 H 1 UNL111111111 0.2143 28 H 1.6665 1.3244 1.8808 H 1 UNL111111111 0.1795 @BOND 1 17 8 2 2 22 11 2 3 21 10 2 4 16 8 2 5 8 1 1 6 10 20 2 7 10 5 1 8 11 23 2 9 11 5 1 10 15 7 2 11 12 6 2 12 1 6 1 13 1 7 1 14 1 2 1 15 5 9 1 16 5 4 1 17 6 13 2 18 19 9 2 19 7 14 2 20 26 3 1 21 3 2 1 22 3 4 1 23 9 18 2 24 2 24 1 25 2 25 1 26 4 28 1 27 4 27 1