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path: root/cad/tests/AMBER_test_structures/mmp/AminoAcids/GLY_GLYCINE.mmp
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mmpformat 080327 required; 080529 preferred
kelvin 300
group (View Data)
info opengroup open = True
csys (HomeView) (1.000000, 0.000000, 0.000000, 0.000000) (10.000000) (0.000000, 0.000000, 0.000000) (1.000000)
csys (LastView) (0.999942, 0.009645, -0.003794, 0.002956) (8.793595) (0.000000, 0.000000, 0.000000) (1.000000)
csys (HomeView1) (1.000000, 0.000000, 0.000000, 0.000000) (10.000000) (0.000000, 0.000000, 0.000000) (1.000000)
csys (LastView1) (0.965474, 0.127192, -0.200452, 0.107242) (9.547311) (0.000000, 0.000000, 0.000000) (1.000000)
egroup (View Data)
group (GLY_GLYCINE)
info opengroup open = True
mol (Chunk1) def
atom 1 (7) (-5575, -1434, 165) def
info atom atomtype = sp2(graphitic)
atom 2 (1) (-6123, -1061, 936) def
bond1 1
atom 3 (1) (-5919, -2234, -360) def
bond1 1
atom 4 (6) (-4257, -796, -204) def
bond1 1
atom 5 (1) (-3880, -215, 637) def
bond1 4
atom 6 (6) (-4404, 207, -1386) def
info atom atomtype = sp2
bond1 4
atom 7 (8) (-4977, -85, -2414) def
info atom atomtype = sp2
bond2 6
atom 8 (8) (-3819, 1534, -1220) def
bond1 6
atom 9 (1) (-4458, 2109, -781) def
bond1 8
atom 10 (1) (-3490, -1524, -431) def
bond1 4
egroup (GLY_GLYCINE)
end1
group (Clipboard)
info opengroup open = False
group (Clipboard item 1)
info opengroup open = True
mol (Chunk1) def
atom 11 (7) (-5956, -1311, 53) def
info atom atomtype = sp2(graphitic)
atom 12 (1) (-6647, -648, 393) def
bond1 11
atom 13 (1) (-6234, -2264, -166) def
bond1 11
atom 14 (6) (-4521, -878, -132) def
bond1 11
atom 15 (1) (-4223, -240, 701) def
bond1 14
atom 16 (6) (-4335, -23, -1421) def
info atom atomtype = sp2
bond1 14
atom 17 (8) (-4820, -345, -2485) def
info atom atomtype = sp2
bond2 16
atom 18 (8) (-3544, 1199, -1313) def
bond1 16
atom 19 (1) (-4100, 1908, -964) def
bond1 18
atom 20 (6) (-3527, -2085, -141) def
bond1 14
atom 21 (1) (-3647, -2708, 744) def
bond1 20
atom 22 (1) (-3647, -2700, -1031) def
bond1 20
mol (CYM_CYSTEINE_with_negative_charge.in_frag) def
atom 23 (16) (-1759, -1529, -132) def
info atom atomtype = sp2
bond1 20
egroup (Clipboard item 1)
egroup (Clipboard)
end molecular machine part GLY_GLYCINE