%chk=000293654.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293654

0 1
O 1.914054 0.569955 1.178962
O -1.825164 -0.957023 2.044434
N 1.926466 0.534749 -1.208477
C 3.344351 0.102012 -1.290845
C 4.098079 0.470193 0.019677
C -0.103189 1.146036 0.127840
C 3.292055 0.069793 1.255011
C 1.342453 0.728059 -0.081156
C -1.007426 -0.093628 0.020201
C -0.487071 2.226606 -0.902144
C 3.368255 -1.419326 -1.525939
C 3.979458 0.840132 -2.479268
C -0.723970 -1.124423 1.122644
C 3.821859 0.673096 2.545824
C -1.826344 2.838849 -0.599669
C -0.693164 -2.540539 0.583275
C -2.952468 2.491305 -1.361099
C -1.956747 3.769540 0.443507
C 0.491577 -3.045404 0.029726
C -1.840366 -3.343496 0.623209
C -4.193713 3.069775 -1.081488
C -3.199985 4.343565 0.719314
C 0.530068 -4.351847 -0.464379
C -1.797992 -4.650485 0.130392
C -4.320861 3.996283 -0.042161
C -0.612355 -5.157605 -0.410810
H -0.197400 1.574316 1.163321
H 4.295278 1.560281 0.032625
H 5.092488 -0.007909 0.041418
H 3.180636 -1.035361 1.330180
H -2.073816 0.222958 0.107620
H -0.911978 -0.552484 -0.983876
H -0.464075 1.790435 -1.924739
H 0.294345 3.016063 -0.922214
H 4.389411 -1.806608 -1.561297
H 2.816549 -1.964183 -0.745019
H 2.883167 -1.669380 -2.479469
H 3.949723 1.927303 -2.343993
H 5.019368 0.539925 -2.630579
H 3.426453 0.630257 -3.405259
H 0.216427 -0.895461 1.683338
H 3.162515 0.428343 3.390267
H 4.826730 0.307216 2.780531
H 3.861447 1.769181 2.494097
H -2.861701 1.769581 -2.170403
H -1.089149 4.042521 1.040445
H -1.704657 -1.527948 2.827186
H 1.384749 -2.414974 -0.033836
H -2.765756 -2.934985 1.034133
H -5.064266 2.795790 -1.674983
H -3.296425 5.062826 1.530760
H 1.450145 -4.742601 -0.894693
H -2.690917 -5.272225 0.164688
H -5.287694 4.444079 0.174775
H -0.579553 -6.175430 -0.793904


%chk=000293654-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293654

0 1
O 2.318884 1.694542 0.997569
O -0.877019 -1.386059 1.913024
N 2.256722 -0.155235 -0.580968
C 3.746176 -0.170440 -0.749959
C 4.379556 1.173698 -0.284487
C 0.167265 0.845503 0.334822
C 3.812535 1.622704 1.073160
C 1.678128 0.714030 0.192958
C -0.589515 -0.362995 -0.253258
C -0.290271 2.191791 -0.330838
C 4.306839 -1.373384 0.053467
C 4.015829 -0.389420 -2.256879
C -0.384461 -1.666954 0.542283
C 4.281060 3.005397 1.523300
C -1.736174 2.555794 -0.026070
C -1.123115 -2.841139 -0.091843
C -2.726830 2.551526 -1.040690
C -2.124272 2.913867 1.292270
C -0.429474 -3.755834 -0.922495
C -2.515088 -3.018470 0.117195
C -4.067737 2.896373 -0.751303
C -3.460901 3.258781 1.587059
C -1.113186 -4.827666 -1.540237
C -3.198999 -4.091283 -0.496248
C -4.439908 3.251774 0.564929
C -2.501008 -4.999058 -1.327932
H -0.054784 0.908032 1.417313
H 4.158576 1.959029 -1.034217
H 5.479418 1.078530 -0.211510
H 4.045325 0.869004 1.852733
H -1.671448 -0.135032 -0.268157
H -0.257652 -0.539143 -1.292365
H -0.141336 2.111055 -1.425018
H 0.380433 2.990815 0.036749
H 5.382684 -1.514309 -0.160255
H 4.179047 -1.235788 1.142380
H 3.770363 -2.294906 -0.233680
H 3.575169 0.428871 -2.853842
H 5.102330 -0.430486 -2.459448
H 3.554883 -1.336130 -2.588219
H 0.700844 -1.894169 0.574168
H 3.784860 3.293978 2.465693
H 5.373977 3.003946 1.688306
H 4.041356 3.764389 0.757887
H -2.444557 2.276974 -2.064865
H -1.371233 2.923425 2.090429
H -0.832484 -2.224946 2.438286
H 0.647209 -3.622059 -1.087256
H -3.048574 -2.312186 0.763439
H -4.818116 2.887495 -1.550348
H -3.740448 3.534248 2.610578
H -0.566318 -5.529011 -2.180980
H -4.274605 -4.220694 -0.328405
H -5.477739 3.520700 0.792342
H -3.032315 -5.831777 -1.802861


