%chk=000206148.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206148

0 1
O -2.966643 -1.948425 -1.415096
O 2.277200 -1.602662 2.209528
N -3.013768 1.345254 0.176918
C -2.353104 0.644469 -0.976942
C -1.430545 -0.449220 -0.495997
C -0.226709 -0.176728 0.181787
C 0.623527 -1.243221 0.545517
C -3.957075 0.428822 0.902314
C -3.717443 2.585612 -0.295522
C -1.765111 -1.800043 -0.754678
C 0.093363 1.210179 0.551202
C 0.247831 -2.570403 0.299408
C 1.948025 -1.024434 1.197050
C -0.944124 -2.864191 -0.358805
C 2.893521 -0.137644 0.446619
C 2.560651 1.181238 0.098264
C 1.294831 1.800237 0.509120
C -4.259206 0.987423 2.293521
C -2.700486 3.686671 -0.600997
C 4.146347 -0.666578 0.095940
C 3.491292 1.953070 -0.626842
C 5.055087 0.101881 -0.629503
C 4.721616 1.413174 -0.995388
C -3.391336 -3.288983 -1.763300
H -1.754016 1.398316 -1.541180
H -3.090989 0.228358 -1.703523
H -4.900283 0.252628 0.342488
H -3.465970 -0.565282 1.009428
H -4.362410 2.403562 -1.182158
H -4.392179 2.932353 0.520289
H -0.788363 1.785690 0.888923
H 0.900216 -3.383516 0.628632
H -1.219444 -3.896236 -0.546606
H 1.386289 2.853765 0.799749
H -3.328797 1.210661 2.833907
H -4.834686 1.918509 2.249101
H -4.827449 0.266675 2.889960
H -2.051337 3.871912 0.264792
H -2.047962 3.422425 -1.441194
H -3.203875 4.626518 -0.849821
H 4.404575 -1.682252 0.401054
H 3.241993 2.975910 -0.904568
H 6.022859 -0.311842 -0.906188
H 5.430790 2.013373 -1.564620
H -3.549055 -3.884206 -0.859222
H -2.668231 -3.754432 -2.439216
H -4.341818 -3.094488 -2.277245


%chk=000206148-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206148

0 1
O -3.342186 -2.061908 -1.299502
O 2.542306 -2.392270 1.058693
N -3.020812 1.400708 0.143107
C -2.560032 0.584431 -1.027263
C -1.593997 -0.543713 -0.670129
C -0.247654 -0.284356 -0.226252
C 0.645206 -1.389047 0.015741
C -3.729134 0.575875 1.164629
C -3.840064 2.559986 -0.310301
C -2.019686 -1.885059 -0.861189
C 0.092466 1.121475 -0.003438
C 0.158163 -2.711788 -0.176694
C 2.066671 -1.343559 0.498603
C -1.143882 -2.973477 -0.612901
C 3.014438 -0.201375 0.257011
C 2.666948 1.183409 0.119158
C 1.315320 1.730496 0.137911
C -3.766808 1.242988 2.552167
C -3.020108 3.666376 -1.002408
C 4.392060 -0.568503 0.237300
C 3.726868 2.138438 -0.004501
C 5.412597 0.382332 0.074958
C 5.075226 1.755480 -0.040027
C -3.827064 -3.431061 -1.500747
H -2.049505 1.272475 -1.726032
H -3.427001 0.148965 -1.570527
H -4.766999 0.322587 0.830324
H -3.184303 -0.380976 1.249807
H -4.665946 2.223770 -0.990048
H -4.322981 2.994468 0.582867
H -0.784062 1.777282 0.059221
H 0.845122 -3.534522 0.041134
H -1.467838 -4.007284 -0.759341
H 1.283353 2.824486 0.246029
H -2.740743 1.466496 2.892669
H -4.341820 2.186779 2.552868
H -4.241791 0.565947 3.286513
H -2.206342 4.011386 -0.339788
H -2.571932 3.328644 -1.953951
H -3.669812 4.530774 -1.233333
H 4.628621 -1.628032 0.371860
H 3.461873 3.199607 -0.083059
H 6.460690 0.065493 0.049549
H 5.860108 2.511700 -0.150699
H -3.802221 -4.009930 -0.557824
H -3.238300 -3.956242 -2.276957
H -4.867416 -3.315855 -1.838311


