%chk=000271322.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271322

0 1
Cl -6.965051 2.761645 0.197588
O 5.331812 1.448897 0.112445
O 3.425895 1.937531 -1.053393
N -0.839227 0.029419 -0.013053
N 1.530509 -0.109111 -0.086089
N -1.037188 -2.812157 -0.114569
N 3.901213 -0.232157 -0.188448
N 1.350464 -4.352071 -0.129062
C 0.195685 -2.191128 -0.104393
C 0.317141 -0.755473 -0.072203
C 1.416146 -2.980324 -0.135797
C -2.018109 -0.591629 -0.009482
C -3.241241 0.238928 0.050372
C 2.643102 -0.882872 -0.147123
C 2.640691 -2.305571 -0.155943
C -2.114097 -2.043019 -0.073777
C -4.361246 -0.202365 0.776404
C -3.276015 1.479318 -0.611985
C -5.517631 0.578019 0.825745
C -4.430048 2.264947 -0.570878
C -5.534253 1.798898 0.145559
C 4.091892 1.153405 -0.435424
C 5.806567 2.827567 -0.103609
C 7.146301 2.852802 0.597502
H 3.574899 -2.853104 -0.198400
H -3.094612 -2.529745 -0.102101
H -4.330371 -1.149107 1.316517
H -2.390107 1.832539 -1.150999
H 4.714266 -0.759032 0.151202
H 0.457216 -4.824756 -0.156578
H 2.176911 -4.916241 -0.207964
H -6.389918 0.244044 1.387318
H -4.464082 3.226733 -1.083858
H 5.870804 2.992320 -1.192886
H 5.059839 3.509236 0.340667
H 7.607534 3.846085 0.533387
H 7.046298 2.595180 1.661621
H 7.844611 2.125746 0.160988


%chk=000271322-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271322

0 1
Cl -7.162438 2.790063 -0.042119
O 5.481944 1.421203 -0.033493
O 3.287341 2.282167 -0.057473
N -0.932802 -0.003938 0.005252
N 1.424235 -0.009115 0.000611
N -0.991561 -2.855659 0.072077
N 3.799383 -0.062071 -0.000376
N 1.354197 -4.283542 0.101901
C 0.197176 -2.164379 0.053718
C 0.246433 -0.721161 0.019434
C 1.440240 -2.913812 0.069420
C -2.109540 -0.685684 0.024109
C -3.357252 0.127276 0.008784
C 2.560905 -0.735658 0.016343
C 2.632859 -2.171318 0.050334
C -2.125464 -2.128053 0.057472
C -4.653478 -0.456822 0.031473
C -3.251586 1.545820 -0.029769
C -5.813057 0.346402 0.016238
C -4.399385 2.360945 -0.045513
C -5.668024 1.746552 -0.022209
C 4.065975 1.313774 -0.033014
C 6.002899 2.816040 -0.064770
C 7.525225 2.717369 -0.058810
H 3.605715 -2.675358 0.061343
H -3.061185 -2.692614 0.072051
H -4.783465 -1.543002 0.061552
H -2.249438 1.984245 -0.046644
H 4.642100 -0.640257 0.013934
H 0.416108 -4.687794 0.112539
H 2.176040 -4.879866 0.113767
H -6.807951 -0.107249 0.033979
H -4.311030 3.450523 -0.075111
H 5.616097 3.314762 -0.972072
H 5.611917 3.356277 0.816616
H 7.964999 3.731091 -0.080714
H 7.883973 2.203436 0.849507
H 7.888493 2.162807 -0.941064


