%chk=000225837.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225837

0 1
O -2.432893 1.401680 -0.171487
O 4.741447 -0.743932 0.088098
O 4.402528 1.364660 -0.249463
N -1.583479 -0.710026 0.186484
N 4.009251 0.224225 -0.057655
C -4.042179 -0.404499 0.157359
C -2.649429 0.230806 0.038318
C -4.971503 0.588031 0.853926
C -4.521852 -0.750081 -1.252804
C -0.194969 -0.428398 0.115385
C 0.698723 -1.517766 0.278584
C 0.306339 0.872225 -0.104643
C 2.560264 -0.001165 0.002103
C 2.067973 -1.300908 0.221747
C 1.677022 1.082845 -0.160571
H -4.000051 -1.339790 0.770172
H -4.665685 0.775280 1.890325
H -6.004730 0.222611 0.872152
H -4.975901 1.562479 0.341160
H -5.525162 -1.194449 -1.228798
H -3.858322 -1.462996 -1.754886
H -4.586458 0.144836 -1.888859
H -1.828908 -1.691746 0.345273
H 0.322513 -2.524423 0.448891
H -0.384026 1.716758 -0.231964
H 2.774193 -2.130624 0.345880
H 2.082195 2.088067 -0.330828


%chk=000225837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225837

0 1
O -2.504658 1.364429 -0.547359
O 4.819955 -0.772123 0.375923
O 4.498588 1.362612 -0.367354
N -1.573179 -0.671199 0.164649
N 4.056671 0.210074 0.017923
C -4.040048 -0.469520 0.006651
C -2.651698 0.172366 -0.153905
C -4.867392 0.348919 1.031005
C -4.743848 -0.506582 -1.375257
C -0.185270 -0.398184 0.112429
C 0.703170 -1.445433 0.495743
C 0.342203 0.858869 -0.302616
C 2.596346 0.000589 0.051607
C 2.091262 -1.252770 0.467425
C 1.733826 1.051815 -0.331203
H -3.934232 -1.509122 0.381251
H -4.400476 0.345417 2.032576
H -5.884544 -0.072325 1.121326
H -4.948645 1.396510 0.693104
H -5.759957 -0.927644 -1.273442
H -4.185403 -1.121276 -2.104392
H -4.825636 0.517231 -1.779532
H -1.826392 -1.613229 0.473762
H 0.299473 -2.413675 0.816481
H -0.344321 1.655037 -0.593308
H 2.787783 -2.043430 0.757023
H 2.163321 2.006345 -0.646610


