@MOLECULE azidoamphenicol 34 34 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 0.5761 -1.4411 1.0334 O.3 1 UNK1 -0.5798 2 O 0.1077 2.6215 -0.2885 O.3 1 UNK1 -0.5647 3 O 3.1506 -1.0740 0.3350 O.2 0 UNK0 -0.5695 4 O -6.1318 0.6574 -0.0089 O.2 1 UNK1 -0.4040 5 O -5.9105 -1.3242 -0.8157 O.2 1 UNK1 -0.3986 6 N 2.2546 0.9766 0.0095 N.am 1 UNK1 -0.5708 7 N -5.4561 -0.3197 -0.2912 N.pl3 1 UNK1 0.6207 8 N 5.6241 0.5004 -0.2809 N.2 0 UNK0 -0.4475 9 N 6.0150 -0.6674 -0.5010 N.2 0 UNK0 0.4382 10 N 6.5194 -1.6144 -0.8672 N.2 0 UNK0 -0.1658 11 C 0.9617 0.4344 -0.4408 C.3 1 UNK1 0.0113 12 C 0.1639 -0.1157 0.7853 C.3 1 UNK1 0.1219 13 C -1.3158 -0.1853 0.5177 C.ar 1 UNK1 0.0153 14 C 0.2248 1.5485 -1.2084 C.3 1 UNK1 -0.0313 15 C -2.1201 0.9163 0.8265 C.ar 1 UNK1 -0.1824 16 C -1.8770 -1.3428 -0.0239 C.ar 1 UNK1 -0.1463 17 C 3.2776 0.1414 0.3543 C.2 0 UNK0 0.5553 18 C -3.4849 0.8753 0.5695 C.ar 1 UNK1 -0.0933 19 C -3.2426 -1.3960 -0.2857 C.ar 1 UNK1 -0.0901 20 C -4.0323 -0.2802 0.0032 C.ar 1 UNK1 -0.0847 21 C 4.6197 0.7667 0.7381 C.3 0 UNK0 -0.1632 22 H 1.1474 -0.4304 -1.1429 H 1 UNK1 0.1794 23 H 0.3838 0.4817 1.7021 H 1 UNK1 0.1479 24 H 0.8097 1.8907 -2.0830 H 1 UNK1 0.1329 25 H -0.7783 1.2216 -1.5382 H 1 UNK1 0.1419 26 H 2.3058 1.9835 0.1010 H 1 UNK1 0.3353 27 H -1.6714 1.8101 1.2642 H 1 UNK1 0.1741 28 H -1.2398 -2.2101 -0.2243 H 1 UNK1 0.1903 29 H 1.5452 -1.5395 0.8585 H 1 UNK1 0.3627 30 H -4.1246 1.7304 0.8067 H 1 UNK1 0.1832 31 H -3.6937 -2.2981 -0.7112 H 1 UNK1 0.1860 32 H -0.4006 3.3580 -0.6836 H 1 UNK1 0.3285 33 H 4.9082 0.4020 1.7545 H 0 UNK0 0.1771 34 H 4.5789 1.8842 0.8000 H 0 UNK0 0.1900 @BOND 1 24 14 1 2 25 14 1 3 14 11 1 4 14 2 1 5 22 11 1 6 10 9 2 7 5 7 2 8 31 19 1 9 32 2 1 10 9 8 2 11 11 6 1 12 11 12 1 13 7 4 2 14 7 20 1 15 19 16 ar 16 19 20 ar 17 8 21 1 18 28 16 1 19 16 13 ar 20 20 18 ar 21 6 26 1 22 6 17 am 23 3 17 2 24 17 21 1 25 13 12 1 26 13 15 ar 27 18 30 1 28 18 15 ar 29 21 34 1 30 21 33 1 31 12 1 1 32 12 23 1 33 15 27 1 34 29 1 1