@MOLECULE n-[(4-chlorobenzoyl)carbamoyl]-beta-d-glucopyranosylamine 41 42 0 0 0 SMALL GASTEIGER @ATOM 1 C -4.6755 -0.8219 -1.0774 C.ar 1 UNL11111111 -0.0523 2 C -5.9890 -0.6381 -0.6538 C.ar 1 UNL11111111 -0.1902 3 C -6.2125 0.1433 0.4729 C.ar 1 UNL11111111 0.0604 4 CL -7.8180 0.3721 1.0076 Cl 1 UNL11111111 -0.0680 5 C -5.1819 0.7495 1.1800 C.ar 1 UNL11111111 -0.1903 6 C -3.8717 0.5601 0.7432 C.ar 1 UNL11111111 -0.0874 7 C -3.6152 -0.2316 -0.3772 C.ar 1 UNL11111111 -0.1589 8 C -2.2587 -0.4831 -0.9390 C.2 1 UNL11111111 0.5875 9 O -2.0911 -1.0191 -2.0038 O.2 1 UNL11111111 -0.3997 10 N -1.1500 -0.0647 -0.1636 N.am 1 UNL11111111 -0.6634 11 C 0.1554 -0.0691 -0.7064 C.2 1 UNL11111111 0.7100 12 O 0.4096 -0.2633 -1.8675 O.2 1 UNL11111111 -0.4410 13 N 1.1494 0.3260 0.2171 N.am 1 UNL11111111 -0.6449 14 C 2.5341 0.2443 -0.2299 C.3 1 UNL11111111 0.2503 15 O 3.0973 -0.7932 0.5577 O.3 1 UNL11111111 -0.4762 16 C 4.4564 -1.0735 0.2448 C.3 1 UNL11111111 0.0516 17 C 4.7894 -2.2789 1.1335 C.3 1 UNL11111111 -0.0161 18 O 4.0874 -3.4148 0.6804 O.3 1 UNL11111111 -0.5308 19 C 5.3086 0.1610 0.6019 C.3 1 UNL11111111 0.0697 20 O 6.6037 -0.1447 0.1364 O.3 1 UNL11111111 -0.5451 21 C 4.7718 1.4012 -0.1403 C.3 1 UNL11111111 0.0692 22 O 5.4758 2.4858 0.4273 O.3 1 UNL11111111 -0.5632 23 C 3.2637 1.5723 0.1112 C.3 1 UNL11111111 0.0279 24 O 2.8604 2.5821 -0.7877 O.3 1 UNL11111111 -0.5494 25 H -4.4663 -1.4262 -1.9687 H 1 UNL11111111 0.1881 26 H -6.8146 -1.0974 -1.1993 H 1 UNL11111111 0.1815 27 H -5.3862 1.3648 2.0566 H 1 UNL11111111 0.1766 28 H -3.0657 1.0507 1.2877 H 1 UNL11111111 0.1504 29 H -1.2995 0.3027 0.7674 H 1 UNL11111111 0.3154 30 H 1.0035 0.2131 1.2127 H 1 UNL11111111 0.3161 31 H 2.6112 -0.0062 -1.3214 H 1 UNL11111111 0.1788 32 H 4.5484 -1.3382 -0.8334 H 1 UNL11111111 0.1600 33 H 5.8569 -2.5626 1.0377 H 1 UNL11111111 0.1659 34 H 4.5349 -2.0970 2.1925 H 1 UNL11111111 0.1272 35 H 3.1334 -3.1949 0.5942 H 1 UNL11111111 0.3222 36 H 5.3558 0.3428 1.6985 H 1 UNL11111111 0.1468 37 H 7.1773 0.6529 0.2158 H 1 UNL11111111 0.3389 38 H 5.0020 1.3655 -1.2305 H 1 UNL11111111 0.1567 39 H 5.1220 3.3314 0.0688 H 1 UNL11111111 0.3409 40 H 3.0566 1.9190 1.1456 H 1 UNL11111111 0.1487 41 H 1.8821 2.5755 -0.8859 H 1 UNL11111111 0.3363 @BOND 1 1 2 ar 2 1 7 ar 3 1 25 1 4 2 3 ar 5 2 26 1 6 3 4 1 7 3 5 ar 8 5 6 ar 9 5 27 1 10 6 7 ar 11 6 28 1 12 7 8 1 13 8 9 2 14 8 10 am 15 10 11 am 16 10 29 1 17 11 12 2 18 11 13 am 19 13 14 1 20 13 30 1 21 14 15 1 22 14 23 1 23 14 31 1 24 15 16 1 25 16 17 1 26 16 19 1 27 16 32 1 28 17 18 1 29 17 33 1 30 17 34 1 31 18 35 1 32 19 20 1 33 19 21 1 34 19 36 1 35 20 37 1 36 21 22 1 37 21 23 1 38 21 38 1 39 22 39 1 40 23 24 1 41 23 40 1 42 24 41 1