%chk=000298362.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298362

0 1
O 1.704999 1.142795 0.680028
O 2.967758 0.569804 -2.158851
O 2.744034 -2.055493 0.298023
O 4.158420 2.032192 0.139507
N -0.195563 0.240078 -0.327948
N -0.963940 2.412793 0.498500
N -0.095253 -2.156163 -1.031978
N -2.232057 -3.321204 -0.880426
N -1.991298 3.083456 1.258043
N -4.742683 0.977857 1.170809
C 1.159456 0.770755 -0.600165
C 2.181938 -0.195754 -1.263699
C 3.044831 -0.735638 -0.093464
C 2.799934 0.255216 1.073834
C 3.985311 1.204057 1.300366
C -1.245013 1.039224 0.241350
C -0.731068 -1.046695 -0.556967
C -2.127478 -1.029243 -0.198814
C -2.424442 0.290093 0.306936
C -2.848749 -2.219868 -0.390176
C -3.691300 0.677959 0.788899
C -0.893332 -3.252574 -1.175382
H 1.061089 1.735204 -1.166281
H 1.738247 -0.992841 -1.906767
H 4.122860 -0.802143 -0.383034
H 2.465276 -0.257474 1.998868
H 4.948739 0.665894 1.389921
H 3.834290 1.843359 2.188512
H 3.614923 1.152439 -1.658194
H 1.775828 -2.252909 0.240959
H -0.058772 2.513987 1.018699
H -3.918097 -2.299357 -0.152189
H 3.400701 2.664228 0.084964
H -0.417793 -4.169943 -1.562702
H -2.866207 3.077181 0.712958
H -1.714288 4.074628 1.314261


%chk=000298362-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298362

0 1
O 1.782008 1.265553 0.721948
O 3.031839 0.755614 -2.040190
O 2.286500 -1.967249 0.432227
O 4.417476 1.984903 0.009585
N -0.196228 0.200896 -0.188533
N -0.969768 2.295817 0.712485
N -0.063252 -2.177748 -0.857855
N -2.204834 -3.344493 -0.935040
N -1.964176 3.220891 1.093704
N -4.856573 1.105619 0.976789
C 1.118950 0.805210 -0.513402
C 2.164534 -0.086745 -1.234946
C 2.926777 -0.759084 -0.053951
C 2.904240 0.314743 1.070859
C 4.171423 1.167882 1.220767
C -1.250392 1.014820 0.291106
C -0.733062 -1.065594 -0.478759
C -2.152014 -1.019646 -0.256173
C -2.476025 0.304356 0.239092
C -2.858081 -2.215806 -0.510845
C -3.753863 0.765947 0.647101
C -0.852597 -3.281112 -1.078976
H 0.926359 1.711021 -1.115817
H 1.714660 -0.817696 -1.921684
H 3.960214 -0.992917 -0.374429
H 2.656339 -0.188867 2.022020
H 5.056461 0.521344 1.336271
H 4.092778 1.829338 2.103600
H 3.701914 1.208054 -1.433502
H 1.488341 -2.207624 -0.159498
H -0.009427 2.521973 0.990254
H -3.941191 -2.295590 -0.375082
H 3.820176 2.774294 0.051638
H -0.337597 -4.194349 -1.386142
H -2.533997 2.917755 1.892339
H -2.516608 3.564390 0.301438


