@MOLECULE 2,5-bis[bis(2-chloroethyl)amino]-1,4-benzoquinone 40 40 0 0 0 SMALL GASTEIGER @ATOM 1 CL 3.6904 -2.3430 1.7452 Cl 1 UNL1111111111 -0.1570 2 CL 5.3879 1.7882 -0.8114 Cl 1 UNL1111111111 -0.1921 3 CL -3.8151 -2.8705 -0.4040 Cl 1 UNL1111111111 -0.1479 4 CL -5.6416 2.1207 0.9476 Cl 1 UNL1111111111 -0.1648 5 O 1.6151 0.2928 -2.3854 O.2 1 UNL1111111111 -0.4976 6 O -1.5369 1.1523 1.7359 O.2 1 UNL1111111111 -0.4899 7 N 2.8042 0.1431 0.1747 N.pl3 1 UNL1111111111 -0.3374 8 N -2.7152 0.0028 -0.5483 N.pl3 1 UNL1111111111 -0.3474 9 C 1.4823 0.3547 -0.0144 C.2 1 UNL1111111111 0.2252 10 C -1.3857 0.2299 -0.4537 C.2 1 UNL1111111111 0.2264 11 C 3.4209 0.3252 1.4974 C.3 1 UNL1111111111 -0.0992 12 C 3.7066 -0.3106 -0.8932 C.3 1 UNL1111111111 -0.0861 13 C -3.2858 -0.6074 -1.7584 C.3 1 UNL1111111111 -0.1010 14 C -3.6886 0.3321 0.5023 C.3 1 UNL1111111111 -0.0842 15 C 0.8858 0.2176 -1.4186 C.2 1 UNL1111111111 0.4991 16 C -0.7957 0.7539 0.8628 C.2 1 UNL1111111111 0.4984 17 C 0.6265 0.7021 1.0012 C.2 1 UNL1111111111 -0.5541 18 C -0.5248 0.0085 -1.5005 C.2 1 UNL1111111111 -0.5564 19 C 3.0899 -0.8232 2.4485 C.3 1 UNL1111111111 -0.2084 20 C 4.1926 0.8515 -1.7511 C.3 1 UNL1111111111 -0.1787 21 C -3.0100 -2.1088 -1.7925 C.3 1 UNL1111111111 -0.2103 22 C -3.9317 1.8450 0.5445 C.3 1 UNL1111111111 -0.1990 23 H 4.5289 0.4260 1.3846 H 1 UNL1111111111 0.1747 24 H 3.0837 1.2967 1.9426 H 1 UNL1111111111 0.1712 25 H 4.5735 -0.8600 -0.4462 H 1 UNL1111111111 0.1683 26 H 3.1833 -1.0684 -1.5339 H 1 UNL1111111111 0.1829 27 H -4.3820 -0.4020 -1.8035 H 1 UNL1111111111 0.1663 28 H -2.8597 -0.1198 -2.6725 H 1 UNL1111111111 0.1681 29 H -4.6434 -0.2163 0.3060 H 1 UNL1111111111 0.1671 30 H -3.3329 -0.0525 1.4937 H 1 UNL1111111111 0.1900 31 H 0.9820 0.9542 1.9966 H 1 UNL1111111111 0.1934 32 H -0.8666 -0.3015 -2.4858 H 1 UNL1111111111 0.1913 33 H 2.0027 -0.9559 2.5999 H 1 UNL1111111111 0.1799 34 H 3.5867 -0.7071 3.4272 H 1 UNL1111111111 0.1625 35 H 3.3866 1.5607 -2.0281 H 1 UNL1111111111 0.1908 36 H 4.6967 0.5123 -2.6710 H 1 UNL1111111111 0.1650 37 H -1.9328 -2.3470 -1.7017 H 1 UNL1111111111 0.1792 38 H -3.4122 -2.5875 -2.6994 H 1 UNL1111111111 0.1610 39 H -3.7499 2.3415 -0.4208 H 1 UNL1111111111 0.1601 40 H -3.3367 2.3506 1.3287 H 1 UNL1111111111 0.1909 @BOND 1 1 19 1 2 2 20 1 3 3 21 1 4 4 22 1 5 5 15 2 6 6 16 2 7 7 9 1 8 7 11 1 9 7 12 1 10 8 10 1 11 8 13 1 12 8 14 1 13 9 15 1 14 9 17 2 15 10 16 1 16 10 18 2 17 11 19 1 18 11 23 1 19 11 24 1 20 12 20 1 21 12 25 1 22 12 26 1 23 13 21 1 24 13 27 1 25 13 28 1 26 14 22 1 27 14 29 1 28 14 30 1 29 15 18 1 30 16 17 1 31 17 31 1 32 18 32 1 33 19 33 1 34 19 34 1 35 20 35 1 36 20 36 1 37 21 37 1 38 21 38 1 39 22 39 1 40 22 40 1