%chk=000187657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187657

0 1
O 5.073252 -1.036258 1.774394
O 1.142434 -0.799528 -1.032855
O -5.193319 -0.056907 -0.640913
N 2.546763 0.014211 0.612912
N 0.209523 0.462190 0.690913
C 3.753364 -0.340372 -0.194615
C 4.672904 0.876838 -0.398311
C 4.496447 -1.481208 0.540416
C 4.029206 1.960215 -1.254077
C 1.277754 -0.149812 -0.008759
C -1.177662 0.296725 0.356605
C -2.125396 0.754034 1.287999
C -1.596490 -0.266589 -0.869477
C -3.890854 0.104273 -0.213530
C -3.492029 0.661825 1.004358
C -2.949040 -0.364087 -1.155958
C -6.250643 0.378496 0.245397
H 3.416968 -0.734569 -1.197710
H 4.988801 1.283925 0.584099
H 5.616203 0.535363 -0.873551
H 3.825132 -2.337526 0.732970
H 5.377046 -1.821058 -0.037057
H 2.687831 0.794182 1.253052
H 3.135859 2.386060 -0.784678
H 3.723103 1.573700 -2.235131
H 4.727396 2.786578 -1.434672
H 0.390186 0.889245 1.599404
H 4.367412 -0.880449 2.434085
H -1.812874 1.185371 2.236859
H -0.854560 -0.632114 -1.591241
H -4.214727 1.020609 1.729878
H -3.299992 -0.795255 -2.092771
H -7.147229 0.131298 -0.338465
H -6.182729 1.455949 0.419458
H -6.223841 -0.190055 1.179176


%chk=000187657-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187657

0 1
O 4.420503 -1.421206 1.707389
O 1.202319 -1.087570 -1.024765
O -5.342964 -0.422153 -0.324480
N 2.539493 0.317191 0.274561
N 0.203916 0.471543 0.450702
C 3.795335 -0.155573 -0.358214
C 4.900729 0.914104 -0.204780
C 4.212803 -1.516031 0.254727
C 4.576996 2.260744 -0.887168
C 1.296369 -0.160523 -0.163075
C -1.184638 0.224603 0.237147
C -2.110127 0.993616 0.985678
C -1.676213 -0.744564 -0.682098
C -3.983497 -0.151304 -0.083175
C -3.502100 0.814170 0.833695
C -3.062085 -0.922714 -0.833144
C -6.324630 0.354029 0.432516
H 3.588700 -0.327481 -1.433869
H 5.118821 1.056653 0.872756
H 5.825224 0.496603 -0.647095
H 3.446037 -2.276792 0.010526
H 5.185790 -1.834461 -0.155915
H 2.595610 1.160572 0.848397
H 3.683601 2.749141 -0.453943
H 4.383012 2.121775 -1.966910
H 5.420994 2.966163 -0.782034
H 0.408346 1.191931 1.146326
H 3.544838 -1.185432 2.109320
H -1.746728 1.745573 1.698973
H -0.967738 -1.340012 -1.260163
H -4.185864 1.426340 1.428964
H -3.453337 -1.664306 -1.536413
H -7.305280 -0.010577 0.092833
H -6.236262 1.437695 0.218288
H -6.221773 0.183552 1.522645


