%chk=000240659.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240659

0 1
O -2.559822 -0.478028 1.743282
O 0.055013 2.061395 -0.536856
O -1.713396 2.025357 0.873167
O 2.662069 -0.415351 1.983724
O 3.295973 -0.294035 -0.186995
N -3.513266 -0.143357 -1.474466
C -0.533567 -0.067806 0.394157
C -1.916400 -0.815941 0.516852
C 0.209739 -0.598234 -0.844356
C -1.751440 -2.345179 0.559371
C 0.371327 -2.121719 -0.812333
C -0.971481 -2.846214 -0.658706
C 0.269470 -0.262575 1.697726
C -0.830265 1.434757 0.282602
C 1.570748 0.530499 1.764097
C -2.807951 -0.428367 -0.608164
C -0.132077 3.498075 -0.792144
C 3.461610 -0.760342 0.915666
C -1.265399 3.694503 -1.773036
C 4.487376 -1.733096 1.380610
H -0.322933 -0.287657 -1.765125
H 1.214612 -0.116874 -0.915372
H -1.245138 -2.626910 1.504706
H -2.751267 -2.822480 0.614933
H 0.872052 -2.453121 -1.743951
H 1.053967 -2.409324 0.011320
H -0.804794 -3.937175 -0.569165
H -1.578725 -2.711438 -1.577100
H 0.503815 -1.344718 1.822908
H -0.380239 -0.019696 2.568182
H 1.774922 1.130518 0.853864
H 1.637280 1.167182 2.664859
H -2.724311 0.510704 1.801215
H 0.860213 3.755599 -1.206685
H -0.306025 4.003925 0.173572
H -2.236623 3.429616 -1.326047
H -1.144088 3.067668 -2.667037
H -1.333491 4.737442 -2.105866
H 5.501785 -1.325350 1.240014
H 4.433241 -2.667871 0.800909
H 4.375289 -1.988283 2.446967


%chk=000240659-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240659

0 1
O -2.112334 -0.524721 1.995380
O -0.156045 2.167373 -0.814136
O -1.339916 1.981458 1.171335
O 3.036395 -0.093456 1.903169
O 3.446301 -2.029870 0.666542
N -3.807941 0.060797 -0.946304
C -0.436659 -0.072767 0.133034
C -1.781431 -0.804023 0.598519
C -0.089923 -0.538948 -1.312606
C -1.654668 -2.343252 0.476177
C 0.050233 -2.075888 -1.418971
C -1.235176 -2.793117 -0.940805
C 0.691971 -0.403759 1.168595
C -0.701850 1.442675 0.221510
C 2.021629 0.312902 0.884675
C -2.902145 -0.327144 -0.272804
C -0.425403 3.650470 -0.826987
C 3.687546 -1.310981 1.665199
C -1.748828 3.933919 -1.539193
C 4.696946 -1.607512 2.751136
H -0.891455 -0.196380 -1.995340
H 0.832357 -0.039886 -1.655417
H -0.920046 -2.674434 1.231848
H -2.625960 -2.784648 0.761164
H 0.254459 -2.340997 -2.473490
H 0.925540 -2.423782 -0.836858
H -1.085012 -3.888664 -0.942376
H -2.058473 -2.583807 -1.652604
H 0.880953 -1.489178 1.151671
H 0.339177 -0.145348 2.182373
H 2.415498 0.064772 -0.115666
H 1.952915 1.405046 1.008401
H -2.100474 0.473771 2.098944
H 0.441874 4.059284 -1.368583
H -0.436628 4.009083 0.216633
H -2.597397 3.494943 -0.988782
H -1.742503 3.526919 -2.564464
H -1.905633 5.026691 -1.601016
H 5.709004 -1.636749 2.310320
H 4.497150 -2.606171 3.175622
H 4.663756 -0.848521 3.545455


