%chk=000257073.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257073

0 1
O 0.653383 2.137771 0.000388
O 4.188818 1.838598 0.000731
O 1.915375 4.002797 0.000787
N 2.266990 0.514684 0.000363
C -0.199805 -0.096752 0.000048
C 0.853582 0.737188 0.000240
C -1.589564 0.418781 -0.000029
C -0.067256 -1.569409 -0.000112
C 2.994380 1.718218 0.000553
C -2.248111 0.651786 1.216516
C -0.016643 -2.267513 -1.216475
C -2.247658 0.652647 -1.216655
C -0.016924 -2.267813 1.216090
C 2.892208 -0.820299 0.000307
C 1.900158 2.817385 0.000529
C -3.565290 1.118630 1.211071
C 0.093215 -3.660493 -1.211531
C -3.564839 1.119485 -1.211372
C 0.092935 -3.660792 1.210829
C -4.224669 1.352032 -0.000191
C 0.151026 -4.357959 -0.000431
H -1.733626 0.473671 2.158197
H -0.074411 -1.724437 -2.158197
H -1.732819 0.475203 -2.158270
H -0.074905 -1.724970 2.157934
H 2.594873 -1.392740 -0.897498
H 2.594443 -1.393018 0.897792
H 3.994753 -0.714285 0.000585
H -4.078126 1.303084 2.153775
H 0.128474 -4.204542 -2.154693
H -4.077323 1.304606 -2.154135
H 0.127976 -4.205073 2.153864
H -5.249981 1.716867 -0.000253
H 0.234263 -5.443438 -0.000555


%chk=000257073-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257073

0 1
O 0.645869 2.155446 0.000699
O 4.226835 1.883860 -0.000336
O 2.016181 4.062774 -0.003444
N 2.266798 0.531765 0.000481
C -0.193183 -0.113825 0.000428
C 0.866005 0.744758 0.000690
C -1.596774 0.434795 0.000101
C -0.048512 -1.610611 0.000327
C 2.980921 1.742369 -0.000231
C -2.274934 0.672641 1.222597
C -0.015601 -2.331499 -1.222133
C -2.272865 0.676561 -1.222774
C -0.014758 -2.331688 1.222658
C 2.965490 -0.762030 0.000000
C 1.913627 2.835958 0.004010
C -3.605306 1.147611 1.221824
C 0.069231 -3.742198 -1.222237
C -3.603249 1.151504 -1.222736
C 0.070059 -3.742389 1.222493
C -4.273874 1.386976 -0.000643
C 0.114786 -4.451963 0.000058
H -1.757501 0.496244 2.172382
H -0.058575 -1.785512 -2.171476
H -1.753801 0.503244 -2.172236
H -0.057030 -1.785844 2.172115
H 2.708684 -1.349631 -0.895800
H 2.709710 -1.349828 0.895962
H 4.044984 -0.538254 -0.000591
H -4.116205 1.335437 2.172675
H 0.097538 -4.285152 -2.173451
H -4.112548 1.342354 -2.173843
H 0.099014 -4.285490 2.173605
H -5.305045 1.757029 -0.000922
H 0.178935 -5.545513 -0.000049


