%chk=000259815.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259815

0 1
O 1.785136 -0.973581 -1.223535
O 2.816432 -2.181628 1.594564
O 3.255452 1.202470 1.172603
O 2.518500 2.542730 -0.706623
O -1.102897 -2.882500 -0.908444
N -0.146669 -0.991316 0.138775
N -2.452381 -0.950001 -0.265999
N 0.044801 1.275965 1.213090
N -2.096021 2.449085 1.371727
N -4.131926 1.522180 0.600835
C 2.160486 -0.989658 1.151188
C 1.242653 -1.474800 0.003837
C 3.190187 -0.026529 0.491098
C 2.762339 0.081211 -0.997366
C 2.109307 1.396012 -1.455694
C -0.630699 0.251262 0.606277
C -1.314158 -1.649108 -0.392957
C -2.046701 0.253256 0.360297
C -2.777873 1.405091 0.769286
C -0.749430 2.332330 1.558132
C -2.307469 -3.558498 -1.395280
H 1.630900 -0.505580 2.000744
H 1.225327 -2.590639 -0.126777
H 4.225176 -0.431747 0.590264
H 3.594031 -0.212676 -1.676254
H 1.009973 1.372003 -1.302563
H 2.316187 1.586115 -2.525235
H 3.227246 -2.031525 2.474333
H 2.376593 1.703784 1.103259
H 3.496747 2.554392 -0.584895
H -0.248696 3.190096 2.041089
H -3.011269 -3.701859 -0.569119
H -1.887886 -4.506212 -1.753254
H -2.757151 -2.973991 -2.204772
H -4.651125 0.789628 0.142601
H -4.615423 2.359839 0.883569


%chk=000259815-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259815

0 1
O 1.608584 -0.400483 -1.334561
O 2.880606 -2.327512 0.960060
O 2.492225 1.390525 1.180860
O 4.041490 2.378452 -0.840423
O -1.203476 -2.935502 -0.757626
N -0.275647 -0.898090 0.039769
N -2.580976 -1.072736 -0.042289
N -0.120891 1.434628 0.918730
N -2.309058 2.455040 1.290623
N -4.333586 1.321253 0.851594
C 2.102759 -1.079272 0.951373
C 1.122377 -1.254913 -0.244821
C 2.981005 0.154613 0.588050
C 2.950067 0.153053 -0.966018
C 3.078338 1.564931 -1.583378
C -0.788696 0.326419 0.492938
C -1.406747 -1.678602 -0.275188
C -2.200568 0.197633 0.440937
C -2.966093 1.320151 0.859473
C -0.951764 2.456131 1.301825
C -2.434706 -3.695224 -1.082695
H 1.582196 -0.922095 1.915724
H 1.119569 -2.314390 -0.554315
H 4.012385 0.027782 0.958763
H 3.723418 -0.541632 -1.347154
H 2.068442 2.024496 -1.592174
H 3.455345 1.512676 -2.616807
H 3.572560 -2.274305 1.666401
H 1.454914 1.472202 1.056791
H 3.655533 2.453985 0.082863
H -0.465917 3.370298 1.652598
H -3.051410 -3.816151 -0.176534
H -2.070523 -4.663274 -1.452146
H -3.012281 -3.161356 -1.855636
H -4.842535 0.499769 0.532919
H -4.827239 2.157102 1.158277


