@MOLECULE lodoxamide diethyl ester 39 39 0 0 0 SMALL GASTEIGER @ATOM 1 CL 0.0046 -1.7276 -0.0027 Cl 1 UNL111111111 -0.0586 2 O 4.8538 -1.2899 -0.4727 O.3 1 UNL111111111 -0.4164 3 O -4.8551 -1.2857 0.4790 O.3 1 UNL111111111 -0.4162 4 O 3.9131 1.6930 0.4336 O.2 1 UNL111111111 -0.4028 5 O -3.9125 1.6897 -0.4548 O.2 1 UNL111111111 -0.4033 6 O 5.4409 -0.6586 1.6179 O.2 1 UNL111111111 -0.4169 7 O -5.4431 -0.6656 -1.6139 O.2 1 UNL111111111 -0.4168 8 N 2.4166 -0.0635 0.2903 N.am 1 UNL111111111 -0.5317 9 N -2.4154 -0.0646 -0.2796 N.am 1 UNL111111111 -0.5329 10 N -0.0056 5.3141 0.0007 N.1 1 UNL111111111 -0.2012 11 C 1.2232 0.6663 0.1501 C.ar 1 UNL111111111 0.2481 12 C -1.2189 0.6630 -0.1455 C.ar 1 UNL111111111 0.2482 13 C 0.0032 -0.0179 0.0007 C.ar 1 UNL111111111 -0.1781 14 C 1.2086 2.0677 0.1630 C.ar 1 UNL111111111 -0.2259 15 C -1.2094 2.0639 -0.1599 C.ar 1 UNL111111111 -0.2264 16 C -0.0016 2.7359 0.0006 C.ar 1 UNL111111111 0.0616 17 C 3.6745 0.5163 0.4278 C.2 1 UNL111111111 0.5196 18 C -3.6717 0.5134 -0.4328 C.2 1 UNL111111111 0.5201 19 C 4.7775 -0.5288 0.6308 C.2 1 UNL111111111 0.4980 20 C -4.7761 -0.5317 -0.6296 C.2 1 UNL111111111 0.4976 21 C -0.0041 4.1580 0.0003 C.1 1 UNL111111111 0.1003 22 C 5.8955 -2.2881 -0.4990 C.3 1 UNL111111111 0.0127 23 C -5.8907 -2.2911 0.4971 C.3 1 UNL111111111 0.0120 24 C 5.7247 -2.9458 -1.8559 C.3 1 UNL111111111 -0.4635 25 C -5.7367 -2.9375 1.8591 C.3 1 UNL111111111 -0.4638 26 H 2.1251 2.6536 0.2974 H 1 UNL111111111 0.2213 27 H -2.1290 2.6460 -0.2929 H 1 UNL111111111 0.2217 28 H 2.3642 -1.0782 0.2357 H 1 UNL111111111 0.3332 29 H -2.3639 -1.0820 -0.2075 H 1 UNL111111111 0.3338 30 H 5.7345 -2.9815 0.3438 H 1 UNL111111111 0.1357 31 H 6.8659 -1.7766 -0.3833 H 1 UNL111111111 0.1400 32 H -5.7104 -2.9867 -0.3415 H 1 UNL111111111 0.1357 33 H -6.8648 -1.7876 0.3612 H 1 UNL111111111 0.1406 34 H 4.7297 -3.3974 -1.9666 H 1 UNL111111111 0.1615 35 H 5.8366 -2.2179 -2.6725 H 1 UNL111111111 0.1666 36 H 6.4706 -3.7354 -2.0086 H 1 UNL111111111 0.1590 37 H -4.7428 -3.3879 1.9850 H 1 UNL111111111 0.1614 38 H -5.8587 -2.2037 2.6704 H 1 UNL111111111 0.1670 39 H -6.4848 -3.7255 2.0085 H 1 UNL111111111 0.1591 @BOND 1 1 13 1 2 2 19 1 3 2 22 1 4 3 20 1 5 3 23 1 6 4 17 2 7 5 18 2 8 6 19 2 9 7 20 2 10 8 11 1 11 8 17 am 12 8 28 1 13 9 12 1 14 9 18 am 15 9 29 1 16 10 21 3 17 11 13 ar 18 11 14 ar 19 12 13 ar 20 12 15 ar 21 14 16 ar 22 14 26 1 23 15 16 ar 24 15 27 1 25 16 21 1 26 17 19 1 27 18 20 1 28 22 24 1 29 22 30 1 30 22 31 1 31 23 25 1 32 23 32 1 33 23 33 1 34 24 34 1 35 24 35 1 36 24 36 1 37 25 37 1 38 25 38 1 39 25 39 1