%chk=000191093.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191093

0 1
O 1.368915 -1.038932 0.389350
O -0.749915 -0.297424 0.284256
O 2.773410 2.734715 0.186819
O 4.639464 0.489528 -0.302632
O 0.260628 2.026955 -1.282489
O 3.385976 -3.307152 0.274734
O -1.461320 -2.024213 -1.009372
O -2.895016 1.943450 -0.930884
O -4.827435 0.810424 -1.020819
N -4.330597 0.718593 1.891223
C 2.417286 1.521296 -0.483844
C 3.305986 0.447318 0.187620
C 0.907520 1.281923 -0.245455
C 2.754429 -0.983458 -0.029635
C 0.513726 -0.202945 -0.403470
C 3.445955 -2.014677 0.876287
C -1.687364 -1.235174 -0.133719
C -2.939601 -1.032306 0.671066
C -3.280918 0.458660 0.889615
C -3.809004 1.042225 -0.425015
H 2.626287 1.624068 -1.572709
H 3.437685 0.695650 1.272090
H 0.600867 1.668568 0.755333
H 2.823643 -1.294076 -1.096521
H 0.437070 -0.577014 -1.443151
H 2.986172 -2.039113 1.881637
H 4.536106 -1.813508 0.950068
H 2.362593 3.503169 -0.274431
H 4.674475 0.417981 -1.280121
H -0.710420 2.105494 -1.083507
H -2.809322 -1.537732 1.655701
H -3.780730 -1.570290 0.172907
H 2.454445 -3.623330 0.247231
H -2.345591 1.016426 1.197821
H -4.014945 0.504195 2.831912
H -5.184597 0.198147 1.703817
H -3.216363 2.381359 -1.768513


%chk=000191093-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191093

0 1
O 1.500133 -1.118950 0.513600
O -0.713837 -0.388535 0.462399
O 2.956565 2.715686 -0.418491
O 4.720416 0.447980 -0.550813
O 0.168535 2.100308 -0.903087
O 3.155446 -3.413545 0.566230
O -1.629429 -1.601988 -1.331061
O -2.692830 1.744153 -0.948231
O -4.957815 1.242089 -0.868972
N -4.665035 0.532118 1.820163
C 2.430869 1.365379 -0.636000
C 3.397424 0.402850 0.070223
C 1.003287 1.217404 -0.093078
C 2.881235 -1.043414 -0.057455
C 0.575727 -0.258415 -0.213905
C 3.693464 -2.064712 0.739851
C -1.756992 -1.077713 -0.208790
C -3.012195 -1.011702 0.635172
C -3.492731 0.469425 0.967156
C -3.832044 1.178743 -0.342001
H 2.416180 1.134184 -1.724382
H 3.455911 0.689564 1.142999
H 0.972906 1.499014 0.980634
H 2.850038 -1.339626 -1.127294
H 0.477436 -0.578556 -1.272477
H 3.702919 -1.768122 1.810702
H 4.726089 -2.088947 0.360542
H 2.314090 3.357675 -0.816037
H 4.979068 1.403946 -0.618083
H -0.789350 2.013120 -0.637850
H -2.811967 -1.490712 1.610409
H -3.818330 -1.561174 0.122146
H 2.186419 -3.371292 0.776721
H -2.638445 0.984687 1.438465
H -4.579177 0.153388 2.761888
H -5.567634 0.404446 1.359920
H -2.936843 2.120044 -1.838012


