%chk=000183581.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183581

0 1
Cl 0.056727 1.087376 -1.401530
Cl -3.135990 -3.985173 1.692273
F 1.513418 -3.505135 -0.164699
O -3.007316 -1.187848 1.871405
N 1.532329 -0.667478 0.074583
N 2.815635 -0.930296 0.472413
C 4.770851 2.425579 -1.101260
C 5.626512 1.156283 -0.960473
C 3.346529 2.109672 -1.597021
C 5.059394 0.188627 0.094463
C 2.783754 0.958955 -0.853911
C 3.590239 0.042821 -0.078648
C 1.481660 0.490006 -0.736814
C 0.425146 -1.487584 0.472666
C -0.723765 -0.864293 0.994633
C 0.448934 -2.889333 0.342741
C -1.820154 -1.648039 1.361863
C -0.642330 -3.682417 0.724939
C -1.777123 -3.058685 1.228654
C -3.164680 0.240757 2.107685
C -3.251889 1.030820 0.832483
C -2.797374 2.357041 0.804003
C -3.805964 0.454671 -0.318904
C -2.898993 3.100935 -0.374893
C -3.898780 1.201051 -1.496333
C -3.446953 2.524437 -1.525606
H 5.258237 3.131519 -1.798666
H 4.714233 2.944088 -0.124174
H 6.663647 1.429334 -0.691193
H 5.686258 0.639745 -1.938877
H 3.363965 1.873891 -2.683543
H 2.696120 3.001948 -1.490902
H 5.272747 0.562907 1.119182
H 5.562071 -0.798914 0.024416
H -0.753049 0.221420 1.103514
H -0.604506 -4.770879 0.623061
H -2.363875 0.582385 2.786805
H -4.136220 0.231288 2.649890
H -2.366230 2.812293 1.693650
H -4.154782 -0.579385 -0.288703
H -2.547136 4.131392 -0.397217
H -4.324793 0.750192 -2.391848
H -3.522004 3.105624 -2.443203


%chk=000183581-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183581

0 1
Cl 0.159995 0.952107 -1.814322
Cl -3.102152 -4.156786 1.653874
F 1.626025 -3.473328 -0.347419
O -2.993417 -1.214126 1.899446
N 1.554491 -0.650437 0.015788
N 2.831566 -0.871148 0.576176
C 4.907311 2.389826 -1.130356
C 5.742950 1.122852 -0.810807
C 3.518798 2.027283 -1.726401
C 5.081295 0.263467 0.300896
C 2.892003 0.917967 -0.920144
C 3.615628 0.085199 -0.002290
C 1.590883 0.419512 -0.877491
C 0.454013 -1.472163 0.397646
C -0.711141 -0.893729 0.952052
C 0.506549 -2.873428 0.238441
C -1.811767 -1.694967 1.334815
C -0.563868 -3.696279 0.625399
C -1.715348 -3.103082 1.166410
C -3.129161 0.239808 2.137273
C -3.331870 1.049797 0.864478
C -2.821678 2.367806 0.773987
C -4.069119 0.514077 -0.220386
C -3.052702 3.146845 -0.382539
C -4.291664 1.288596 -1.379619
C -3.787641 2.608143 -1.463133
H 5.455309 3.035239 -1.842194
H 4.769749 2.976175 -0.199723
H 6.761949 1.412599 -0.492874
H 5.850293 0.516743 -1.732473
H 3.645679 1.701335 -2.778925
H 2.862829 2.918081 -1.754138
H 5.200681 0.770731 1.279397
H 5.576547 -0.720316 0.391729
H -0.747648 0.191561 1.063074
H -0.495782 -4.778240 0.489464
H -2.263104 0.611853 2.720822
H -4.023899 0.285064 2.782190
H -2.242825 2.789319 1.606174
H -4.453570 -0.509737 -0.154247
H -2.652651 4.164973 -0.443266
H -4.857102 0.864280 -2.216701
H -3.961932 3.208127 -2.363182


