%chk=000251635.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251635

0 1
O 5.914279 1.315111 -0.659984
O 0.088659 -0.401408 2.556293
O -4.913782 -0.207631 0.278862
O -5.885059 0.910088 -1.427867
C 0.728583 0.445379 -0.351014
C 1.570547 -0.812613 0.004708
C 2.975666 -0.630532 -0.577389
C 3.664294 0.615396 0.056979
C -0.690795 0.350919 0.302286
C 1.436288 1.769662 0.019084
C 2.905710 1.854824 -0.427459
C 4.015207 -1.758309 -0.422653
C 0.892248 -2.070137 -0.566881
C -1.300823 -1.023534 0.056808
C -1.579320 1.448283 -0.346286
C 5.110864 0.443873 -0.449557
C 5.368075 -1.049381 -0.639915
C -0.581819 -2.090933 -0.318723
C -0.647261 0.595925 1.835918
C 3.755945 0.580441 1.588386
C -2.775490 -1.168125 0.325662
C -3.059719 1.342858 0.020922
C -3.581826 -0.048278 -0.334336
C -6.000964 0.321830 -0.378705
C -7.233187 0.038206 0.407338
H 0.582794 0.441011 -1.460912
H 1.629815 -0.903190 1.119842
H 2.862939 -0.440462 -1.677474
H 1.392331 1.916587 1.120099
H 0.879809 2.617585 -0.423904
H 2.974353 1.944283 -1.527849
H 3.371832 2.775971 -0.027421
H 3.855790 -2.566960 -1.152006
H 3.962296 -2.221386 0.577054
H 1.363972 -2.974598 -0.132044
H 1.068977 -2.141668 -1.662044
H -1.474309 1.388376 -1.449500
H -1.201683 2.450754 -0.066022
H 5.776566 -1.238096 -1.648539
H 6.142983 -1.399243 0.063355
H -1.050955 -3.061513 -0.484748
H -1.665587 0.644621 2.262649
H -0.096414 1.524406 2.086666
H 2.755478 0.527854 2.045094
H 4.313072 -0.288802 1.953318
H 4.247032 1.481230 1.974272
H -3.160282 -2.150423 -0.016721
H -2.960455 -1.158815 1.423052
H -3.221564 1.546699 1.097213
H -3.646115 2.113759 -0.520841
H -3.691110 -0.187865 -1.431282
H -0.224108 -1.299679 2.312799
H -7.178191 0.475288 1.416738
H -7.385354 -1.044145 0.543134
H -8.123032 0.448206 -0.095156


%chk=000251635-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251635

0 1
O 5.865270 1.384548 -1.090884
O 0.080826 -0.319903 2.849485
O -5.049814 -0.245068 0.189707
O -5.735795 0.725847 -1.821317
C 0.738750 0.452122 -0.096834
C 1.602554 -0.834139 0.135333
C 2.964204 -0.636533 -0.557052
C 3.735144 0.612502 -0.036978
C -0.705188 0.368242 0.533959
C 1.502325 1.748181 0.309125
C 2.905230 1.875019 -0.343796
C 4.026264 -1.769419 -0.547617
C 0.875867 -2.080515 -0.418476
C -1.330144 -1.020428 0.302232
C -1.607929 1.451646 -0.158869
C 5.078145 0.460605 -0.774653
C 5.303916 -1.044038 -1.062803
C -0.604954 -2.097300 -0.112190
C -0.708865 0.646245 2.073847
C 4.101722 0.534230 1.481679
C -2.829147 -1.151654 0.562809
C -3.124393 1.329623 0.125200
C -3.614493 -0.084346 -0.216423
C -6.016588 0.218927 -0.710834
C -7.405406 0.035184 -0.137964
H 0.576890 0.504818 -1.199598
H 1.751051 -0.964532 1.223523
H 2.739644 -0.428941 -1.631427
H 1.622811 1.778056 1.407691
H 0.902872 2.636926 0.033871
H 2.802413 1.986837 -1.442071
H 3.417067 2.783571 0.024614
H 3.744839 -2.622000 -1.189701
H 4.175860 -2.162579 0.475393
H 1.349109 -3.002837 -0.025544
H 1.009656 -2.128938 -1.522871
H -1.447482 1.376170 -1.253009
H -1.270420 2.462372 0.139903
H 5.429944 -1.163726 -2.156383
H 6.246552 -1.387438 -0.599747
H -1.130705 -3.050462 -0.276268
H -1.751406 0.661978 2.451335
H -0.257351 1.625554 2.298339
H 3.202646 0.458815 2.115932
H 4.744490 -0.334360 1.713062
H 4.655706 1.445893 1.769200
H -3.179706 -2.159893 0.278703
H -3.065474 -1.019200 1.638705
H -3.350152 1.537673 1.188461
H -3.673012 2.072935 -0.480958
H -3.549483 -0.254158 -1.308248
H -0.215867 -1.230617 2.584350
H -7.628489 0.864233 0.558436
H -7.475300 -0.906369 0.429301
H -8.147003 0.052340 -0.950381


