@MOLECULE n-[4-(hydroxyamino)-4-oxo-2-[phenyl(~3~h_1_)methyl](2-~3~h)butanoyl]glycine 36 36 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.4140 -0.2346 1.5000 O.2 1 UNL1 -0.5606 2 O -2.1711 3.5477 -0.7752 O.2 1 UNL1 -0.5113 3 O -3.1185 2.7094 1.5459 O.3 1 UNL1 -0.2822 4 O -3.3759 -3.1450 0.7259 O.3 1 UNL1 -0.5293 5 O -2.8143 -2.6482 -1.3394 O.2 1 UNL1 -0.4279 6 N -0.4400 -1.4358 -0.3994 N.am 1 UNL1 -0.5640 7 N -2.4189 1.8436 0.7008 N.am 1 UNL1 -0.3932 8 C 0.2756 0.9602 -0.4594 C.3 1 UNL1 -0.1755 9 C 1.4540 0.6397 -1.3949 C.3 1 UNL1 -0.2852 10 C -0.8829 1.5899 -1.2390 C.3 1 UNL1 -0.3705 11 C 2.6675 0.2395 -0.6087 C.ar 1 UNL1 -0.0058 12 C -0.2123 -0.2678 0.2990 C.2 1 UNL1 0.5800 13 C -1.8108 2.4493 -0.4026 C.2 1 UNL1 0.5340 14 C 2.9925 -1.1066 -0.4411 C.ar 1 UNL1 -0.1711 15 C 3.4818 1.2260 -0.0469 C.ar 1 UNL1 -0.1653 16 C -1.0337 -2.5727 0.2944 C.3 1 UNL1 -0.1845 17 C 4.1298 -1.4654 0.2803 C.ar 1 UNL1 -0.1389 18 C 4.6170 0.8644 0.6740 C.ar 1 UNL1 -0.1347 19 C 4.9445 -0.4812 0.8361 C.ar 1 UNL1 -0.1499 20 C -2.4617 -2.7672 -0.2008 C.2 1 UNL1 0.6007 21 H 0.6437 1.6929 0.3161 H 1 UNL1 0.1913 22 H 1.6913 1.5356 -2.0121 H 1 UNL1 0.1671 23 H -3.6529 3.3093 0.9283 H 1 UNL1 0.3105 24 H -3.0881 -3.0795 1.6643 H 1 UNL1 0.3479 25 H -0.4056 -1.4877 -1.4054 H 1 UNL1 0.3248 26 H -1.9258 1.2064 1.3195 H 1 UNL1 0.3324 27 H 1.1809 -0.1390 -2.1306 H 1 UNL1 0.1496 28 H -1.4881 0.8235 -1.7716 H 1 UNL1 0.1829 29 H -0.4794 2.2422 -2.0516 H 1 UNL1 0.1945 30 H 2.3591 -1.8797 -0.8696 H 1 UNL1 0.1500 31 H 3.2326 2.2779 -0.1721 H 1 UNL1 0.1560 32 H -0.9817 -2.4196 1.4034 H 1 UNL1 0.1984 33 H -0.4440 -3.4980 0.0796 H 1 UNL1 0.1745 34 H 4.3801 -2.5163 0.4098 H 1 UNL1 0.1501 35 H 5.2520 1.6326 1.1125 H 1 UNL1 0.1529 36 H 5.8322 -0.7627 1.3972 H 1 UNL1 0.1525 @BOND 1 27 9 1 2 29 10 1 3 22 9 1 4 28 10 1 5 25 6 1 6 9 11 1 7 9 8 1 8 5 20 2 9 10 8 1 10 10 13 1 11 30 14 1 12 2 13 2 13 11 14 ar 14 11 15 ar 15 8 12 1 16 8 21 1 17 14 17 ar 18 13 7 am 19 6 16 1 20 6 12 am 21 20 16 1 22 20 4 1 23 31 15 1 24 15 18 ar 25 33 16 1 26 17 34 1 27 17 19 ar 28 16 32 1 29 12 1 2 30 18 19 ar 31 18 35 1 32 7 26 1 33 7 3 1 34 4 24 1 35 19 36 1 36 23 3 1