%chk=000191195.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191195

0 1
O -2.036815 -0.877101 -0.894505
O -0.681337 1.466502 1.525274
O -3.367563 2.491077 0.951553
O -5.151853 0.146561 0.750372
O -3.473422 -2.783085 -1.965954
O -5.318424 -1.540314 -1.665193
N 0.162901 -0.401961 -0.748774
C -1.551514 1.098669 0.448679
C -3.008812 1.102255 0.957863
C -1.064050 -0.333524 0.051122
C -3.944239 0.326445 0.007884
C -3.334182 -1.061449 -0.317514
C 1.386480 0.009373 0.007192
C -4.163123 -1.774489 -1.379881
C 2.590969 -0.002183 -0.948361
C 3.857090 0.286257 -0.189181
C 4.308158 1.606886 -0.042394
C 4.591145 -0.764503 0.382334
C 5.484018 1.870655 0.665248
C 5.766018 -0.494852 1.088813
C 6.215460 0.821901 1.231496
H -1.435574 1.830938 -0.381530
H -3.088501 0.716202 2.000672
H -0.989758 -0.988651 0.950425
H -4.152213 0.908719 -0.918651
H -3.273615 -1.705934 0.594336
H 0.064372 0.106493 -1.633123
H 1.279537 1.007931 0.492873
H 1.544782 -0.725959 0.829029
H -0.937399 2.358527 1.864322
H -4.296986 2.594812 1.266950
H -5.861668 -0.209064 0.150321
H 2.449563 0.733971 -1.764784
H 2.654780 -0.988872 -1.457410
H -4.007015 -3.253713 -2.672091
H 3.743146 2.427787 -0.478367
H 4.245043 -1.790960 0.275829
H 5.830916 2.896737 0.775675
H 6.332959 -1.313373 1.529447
H 7.130725 1.029387 1.781203


%chk=000191195-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191195

0 1
O -1.133755 0.007453 -0.464513
O -2.399193 3.108753 1.306446
O -4.770466 1.903109 0.388135
O -4.744945 -0.947082 0.067527
O -0.902610 -2.724057 -0.983978
O -3.135222 -2.636538 -1.595385
N 0.087055 1.984006 0.235006
C -2.375718 1.998237 0.355772
C -3.580118 1.073201 0.604084
C -1.052485 1.224682 0.525594
C -3.575108 -0.150799 -0.314648
C -2.232274 -0.892592 -0.108116
C 1.434550 1.478026 0.519687
C -2.158962 -2.144122 -0.972281
C 2.061925 0.627850 -0.633757
C 3.400718 0.039675 -0.222151
C 4.607998 0.765549 -0.397459
C 3.465106 -1.233260 0.404236
C 5.844358 0.237799 0.039024
C 4.698522 -1.765200 0.843215
C 5.893857 -1.030303 0.663297
H -2.441194 2.374112 -0.690146
H -3.558491 0.720434 1.659569
H -0.984559 0.764221 1.534808
H -3.640804 0.168407 -1.375505
H -2.156193 -1.215363 0.958635
H -0.004160 2.713156 -0.473673
H 2.103026 2.329133 0.753250
H 1.378187 0.855164 1.432493
H -3.332632 3.451860 1.312665
H -5.561629 1.308047 0.450945
H -4.806297 -1.700528 -0.579407
H 2.180594 1.277445 -1.523133
H 1.336934 -0.163089 -0.893630
H -0.913646 -3.533064 -1.566136
H 4.578517 1.747363 -0.887545
H 2.541260 -1.810623 0.537004
H 6.766701 0.811153 -0.109830
H 4.729571 -2.751761 1.320229
H 6.851584 -1.442354 1.000873


