@MOLECULE 2-azidoethyl 2-acetamido-4-o-(2-acetamido-2-deoxy-beta-d-galactopyranosyl)-2-deoxy-beta-d-glucopyranoside 34 35 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.6376 0.8963 0.3745 O.3 1 UNL1 0.0064 2 C 4.4156 -0.1571 0.4444 C.1 1 UNL1 0.0033 3 C 5.1661 -1.1209 0.4573 C.1 1 UNL1 0.0012 4 N 6.0734 -2.0949 0.4572 N.2 1 UNL1 -0.2986 5 N 5.8965 -3.1268 1.1795 N.2 1 UNL1 0.4014 6 N 5.9546 -4.1363 1.6886 N.2 1 UNL1 -0.1245 7 C -2.0171 -0.5237 -0.8231 C.3 1 UNL1 0.1962 8 C 2.5483 0.7082 -0.4396 C.3 1 UNL1 0.1743 9 C -2.3064 0.3649 0.2401 C.2 1 UNL1 0.0582 10 N -1.5126 1.3812 0.4451 N.am 1 UNL1 -0.4103 11 C 1.6819 1.7969 -0.7029 C.2 1 UNL1 0.0977 12 N 1.9054 2.9650 -0.1642 N.am 1 UNL1 -0.4341 13 C -3.5621 0.0802 1.0145 C.2 1 UNL1 0.3141 14 O -4.1154 0.9182 1.6636 O.2 1 UNL1 -0.2650 15 C 0.5297 1.4399 -1.6391 C.2 1 UNL1 0.4143 16 O 0.0956 2.2182 -2.4387 O.2 1 UNL1 -0.3053 17 C -4.1481 -1.3131 0.8470 C.2 1 UNL1 0.3810 18 O -5.0196 -1.7145 1.5759 O.2 1 UNL1 -0.3558 19 C 0.1027 0.0468 -1.4626 C.3 1 UNL1 0.0105 20 O -1.1675 -0.2657 -1.8617 O.3 1 UNL1 -0.1535 21 C -3.6423 -2.0869 -0.2721 C.2 1 UNL1 -0.3060 22 O -2.4747 -1.7864 -0.9699 O.2 1 UNL1 -0.1594 23 C 1.0019 -0.9027 -0.9746 C.2 1 UNL1 -0.0651 24 O 2.3576 -0.5547 -0.8900 O.2 1 UNL1 -0.1766 25 C -4.2472 -3.2051 -0.6981 C.1 1 UNL1 0.5299 26 O -4.7765 -4.1681 -1.0360 O.2 1 UNL1 -0.1395 27 C 0.7504 -2.1628 -0.5534 C.1 1 UNL1 0.3681 28 O 0.5528 -3.2665 -0.2854 O.2 1 UNL1 -0.1174 29 C -1.6462 2.2910 1.5241 C.2 1 UNL1 0.2000 30 O -1.7142 1.8853 2.6855 O.2 1 UNL1 -0.4367 31 C 1.0255 4.0612 -0.2553 C.2 1 UNL1 0.2276 32 O -0.2020 3.9559 -0.3591 O.2 1 UNL1 -0.4905 33 C -1.5855 3.6980 1.2588 C.3 1 UNL1 0.4143 34 C 1.6575 5.3366 -0.1178 C.3 1 UNL1 0.4397 @BOND 1 16 15 2 2 20 19 1 3 20 7 1 4 15 19 1 5 15 11 1 6 19 23 1 7 26 25 2 8 23 24 1 9 23 27 2 10 22 7 1 11 22 21 1 12 24 8 1 13 7 9 1 14 11 8 1 15 11 12 2 16 25 21 2 17 27 28 2 18 8 1 1 19 32 31 2 20 21 17 1 21 31 12 1 22 31 34 1 23 9 10 2 24 9 13 1 25 1 2 1 26 2 3 3 27 10 29 1 28 4 3 1 29 4 5 2 30 17 13 1 31 17 18 2 32 13 14 2 33 5 6 2 34 33 29 1 35 29 30 2