%chk=000225413.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225413

0 1
O -4.975238 -0.975624 1.317841
N 4.933520 -0.620134 -0.157548
N -0.444065 1.086461 -0.683026
C 3.601005 -0.115690 -0.242215
C -1.516117 0.429398 -0.364274
C -3.966147 0.650034 -0.102085
C -2.747255 -1.468619 0.635685
C 0.884613 0.607954 -0.509411
C -2.805087 1.133641 -0.572540
C -1.602467 -0.952602 0.161719
C -4.002653 -0.633148 0.680192
C 3.109630 0.416325 -1.459845
C 2.704779 -0.259724 0.842459
C 1.775417 0.779888 -1.589156
C 1.364868 0.090374 0.707814
C -5.275817 1.327700 -0.303322
C -2.877653 -2.861935 1.138669
C 5.920135 -0.037207 -1.109727
C 5.508140 -0.737697 1.211989
H -2.747724 2.077584 -1.123844
H -0.682671 -1.542076 0.120792
H 3.774283 0.539653 -2.313210
H 3.051091 -0.655906 1.794977
H 1.407848 1.199145 -2.527092
H 0.691356 -0.015340 1.558274
H -5.998238 1.051824 0.485265
H -5.728047 1.034522 -1.262910
H -5.189314 2.422135 -0.299756
H -1.959408 -3.229478 1.614499
H -3.123877 -3.554597 0.318807
H -3.692808 -2.949050 1.879391
H 5.568111 -0.190093 -2.145392
H 6.878909 -0.573380 -1.017720
H 6.104391 1.037637 -0.957285
H 6.496109 -1.223387 1.154426
H 4.866430 -1.394012 1.825941
H 5.622752 0.226622 1.731116


%chk=000225413-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225413

0 1
O -5.168332 -1.158681 1.024298
N 5.022169 -0.289098 -0.042363
N -0.447094 0.962419 -0.905841
C 3.672698 0.004302 -0.230106
C -1.549012 0.362021 -0.421664
C -4.010099 0.617874 -0.134148
C -2.801216 -1.484627 0.675226
C 0.867596 0.583645 -0.633133
C -2.805369 1.082520 -0.616014
C -1.612604 -0.956994 0.215727
C -4.062301 -0.695212 0.562973
C 3.203877 0.607605 -1.446666
C 2.703457 -0.254485 0.796839
C 1.850749 0.911208 -1.620895
C 1.343678 0.011118 0.594413
C -5.307450 1.375982 -0.279423
C -2.908694 -2.863596 1.280440
C 6.003345 0.046538 -1.085154
C 5.479289 -0.897540 1.215667
H -2.730274 2.043284 -1.137532
H -0.699306 -1.561195 0.257844
H 3.906831 0.853103 -2.247132
H 3.022038 -0.644546 1.767666
H 1.501743 1.393455 -2.539617
H 0.642106 -0.154419 1.418790
H -5.741004 1.601197 0.712565
H -6.061517 0.760825 -0.803835
H -5.163936 2.320145 -0.831182
H -1.929905 -3.371821 1.308861
H -3.622364 -3.485830 0.709665
H -3.317667 -2.806143 2.306047
H 5.776931 -0.471032 -2.038449
H 7.006344 -0.268558 -0.758847
H 6.034931 1.136372 -1.285021
H 6.559891 -1.098582 1.154003
H 4.964757 -1.858808 1.410657
H 5.304520 -0.231245 2.084842


