%chk=000295341.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295341

0 1
O -2.616694 1.208370 0.073476
N 3.809589 0.113428 0.382987
N -4.074472 -0.534549 -0.334685
N -1.748394 -0.950392 -0.070925
C 2.420120 -0.110517 0.180863
C 4.778722 -0.803579 -0.290688
C 4.289755 1.518130 0.495270
C -5.266088 0.348614 -0.130351
C 1.942961 -1.375757 -0.232608
C 1.471583 0.892546 0.498461
C -0.351589 -0.619755 -0.001602
C 5.234177 -1.877803 0.699257
C 4.254536 2.302785 -0.817169
C 0.576446 -1.626647 -0.324902
C 0.107659 0.643527 0.412057
C -5.719777 0.324121 1.333643
C -6.375168 -0.127399 -1.072759
C -2.790406 0.010016 -0.085901
H 4.333451 -1.275844 -1.194953
H 5.661168 -0.231307 -0.652622
H 3.673479 2.035983 1.267562
H 5.326056 1.487992 0.901349
H -4.955611 1.396428 -0.404828
H 2.638063 -2.175965 -0.477268
H 1.802523 1.876967 0.827416
H 5.728956 -1.431240 1.570803
H 4.384502 -2.453074 1.089171
H 5.933663 -2.577391 0.232177
H 4.912529 1.866695 -1.576113
H 3.243313 2.326323 -1.245331
H 4.569023 3.341062 -0.665572
H 0.239551 -2.609716 -0.647026
H -0.608990 1.436360 0.657891
H -4.241386 -1.526969 -0.198441
H -1.953972 -1.910326 -0.344876
H -6.584496 0.979534 1.487493
H -6.005928 -0.676719 1.670004
H -4.922731 0.683786 1.998366
H -6.025935 -0.157792 -2.113325
H -7.232730 0.554504 -1.035585
H -6.742756 -1.127129 -0.819814


%chk=000295341-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295341

0 1
O -2.750903 1.339109 0.131243
N 3.840074 0.137235 0.054061
N -4.122485 -0.514356 -0.253015
N -1.794950 -0.775131 -0.332313
C 2.451237 -0.071783 -0.038787
C 4.802150 -0.919496 -0.301593
C 4.394159 1.423463 0.512549
C -5.371821 0.251078 -0.051356
C 1.904431 -1.352001 -0.367702
C 1.514278 0.984640 0.188929
C -0.400286 -0.489459 -0.225957
C 5.121166 -1.893672 0.859638
C 4.563528 2.469868 -0.616421
C 0.514332 -1.547465 -0.461236
C 0.123600 0.787435 0.102422
C -5.757914 0.321765 1.446131
C -6.494207 -0.360477 -0.914152
C -2.871577 0.100238 -0.127793
H 4.427392 -1.482721 -1.177643
H 5.738311 -0.430654 -0.633131
H 3.757041 1.834589 1.318338
H 5.379837 1.224119 0.975560
H -5.152015 1.277040 -0.397695
H 2.559089 -2.211176 -0.539295
H 1.867679 1.992554 0.424675
H 5.550050 -1.347627 1.719499
H 4.208034 -2.406577 1.208717
H 5.852055 -2.659989 0.538751
H 5.243318 2.090881 -1.401235
H 3.594285 2.699608 -1.092008
H 4.987970 3.410503 -0.217263
H 0.138542 -2.549186 -0.712461
H -0.566658 1.615505 0.274690
H -4.199764 -1.531482 -0.315348
H -2.016164 -1.732233 -0.613970
H -6.656751 0.950397 1.587286
H -5.975725 -0.686487 1.847581
H -4.931073 0.764074 2.027577
H -6.216224 -0.363032 -1.982954
H -7.425969 0.220641 -0.797370
H -6.713367 -1.402438 -0.606044


