%chk=000212265.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212265

0 1
Cl 5.655109 -1.818683 1.185225
O 1.376504 1.306776 -1.334944
O 0.384430 -1.633254 1.416075
N -0.341201 -0.675120 -0.546368
N 0.205609 1.966152 1.550238
N -1.400608 2.643371 0.090401
N -1.038104 1.915869 2.088602
N -1.993808 2.332542 1.196857
C 2.028161 -0.526017 0.106701
C 2.372222 0.608506 -0.644077
C -1.732616 -1.019238 -0.450871
C 0.631430 -0.993258 0.405896
C 3.069145 -1.279227 0.677898
C -4.467711 -1.641339 -0.391806
C 3.704370 1.012421 -0.826456
C -2.204002 -2.015873 0.417541
C -2.630426 -0.324785 -1.288858
C -3.566462 -2.319592 0.440426
C -3.985572 -0.640744 -1.254583
C 4.392779 -0.884094 0.484752
C 4.727068 0.255052 -0.259950
C 1.013640 2.602803 -0.789413
C -5.926388 -1.964268 -0.369596
C -0.006091 2.417455 0.277528
H -0.080363 -0.074302 -1.344521
H 2.825014 -2.162329 1.282976
H 3.926560 1.896274 -1.422777
H -1.512235 -2.549342 1.076952
H -2.276440 0.464022 -1.950867
H -3.925430 -3.095068 1.115876
H -4.678555 -0.101611 -1.899192
H 5.772212 0.541182 -0.393557
H 0.585939 3.109481 -1.683922
H 1.908905 3.139423 -0.422508
H -6.280825 -2.278530 -1.361505
H -6.170754 -2.773713 0.330061
H -6.522235 -1.089665 -0.071280
H -1.218970 1.566620 3.030645


%chk=000212265-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212265

0 1
Cl 5.587834 -2.003321 1.058145
O 0.691525 1.216523 -0.410285
O 0.511743 -3.011298 0.121636
N -0.720307 -1.043773 -0.223375
N 1.833618 4.128413 0.861043
N -0.460768 4.126813 0.716200
N 1.243740 4.966095 1.761927
N -0.146919 4.994765 1.707271
C 1.720167 -0.912663 0.134040
C 1.860957 0.498556 -0.047287
C -2.037706 -1.559206 -0.362515
C 0.453266 -1.744433 0.004210
C 2.880886 -1.653564 0.472667
C -4.753459 -2.419399 -0.665798
C 3.111204 1.135056 0.130521
C -2.357536 -2.941897 -0.317595
C -3.082924 -0.613126 -0.555882
C -3.701449 -3.347632 -0.468576
C -4.414556 -1.040200 -0.704217
C 4.118212 -1.015027 0.627905
C 4.252045 0.376116 0.467054
C 0.793971 2.609522 -0.892636
C -6.192855 -2.873465 -0.836037
C 0.739013 3.611678 0.219223
H -0.610882 -0.023176 -0.309272
H 2.758762 -2.734117 0.595960
H 3.210668 2.220255 0.049735
H -1.558825 -3.669127 -0.163864
H -2.848575 0.459143 -0.579240
H -3.933628 -4.418935 -0.431043
H -5.204675 -0.293029 -0.848611
H 5.219228 0.866767 0.607585
H -0.094737 2.737926 -1.529175
H 1.705992 2.734897 -1.501293
H -6.570756 -2.643861 -1.850924
H -6.293250 -3.961513 -0.681401
H -6.864803 -2.367284 -0.117735
H 1.776079 5.525417 2.429241


