%chk=000213512.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213512

0 1
N -2.529449 -1.409006 0.006253
N 2.525864 -1.417664 0.000158
C -1.269770 -0.607940 0.002797
C 1.268886 -0.612273 -0.000314
C 0.001012 1.166756 -1.263936
C 0.004127 1.173049 1.257509
C -0.001964 -1.511505 0.003493
C -1.260967 0.280353 -1.266845
C -1.257840 0.286656 1.267947
C 1.259979 0.276075 -1.269951
C 1.263101 0.282411 1.264880
C 0.004072 2.060358 -0.005433
H 0.000968 1.808541 -2.173714
H 0.006310 1.819350 2.164074
H -0.002014 -2.167237 0.887780
H -0.004177 -2.171639 -0.877514
H -2.174154 0.903878 -1.288697
H -1.294860 -0.338141 -2.179088
H -1.289441 -0.327247 2.183371
H -2.170968 0.910306 1.288967
H 1.289498 -0.342508 -2.182288
H 2.175215 0.896517 -1.294066
H 2.178392 0.902958 1.283640
H 1.294853 -0.331608 2.180217
H 0.888666 2.720868 -0.008177
H -0.878303 2.723827 -0.005999
H -2.598540 -2.002171 0.826178
H -2.599379 -2.007889 -0.809433
H 2.592361 -2.016026 -0.816225
H 2.594423 -2.011847 0.819416


%chk=000213512-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213512

0 1
N -2.550526 -1.410246 0.006467
N 2.546932 -1.418845 0.000166
C -1.295472 -0.618476 0.002849
C 1.294552 -0.622807 -0.000336
C 0.000970 1.166092 -1.270620
C 0.004122 1.172477 1.264149
C -0.001911 -1.495907 0.003509
C -1.273368 0.280012 -1.262962
C -1.270202 0.286359 1.264129
C 1.272330 0.275693 -1.266144
C 1.275457 0.282054 1.261023
C 0.004144 2.066853 -0.005477
H 0.000909 1.799629 -2.178837
H 0.006288 1.810569 2.169168
H -0.001905 -2.152890 0.900309
H -0.004081 -2.157509 -0.889894
H -2.186712 0.904422 -1.272628
H -1.298365 -0.358333 -2.171758
H -1.292860 -0.347481 2.176139
H -2.183563 0.910757 1.273001
H 1.292870 -0.362789 -2.174952
H 2.187748 0.897022 -1.278146
H 2.190928 0.903380 1.267709
H 1.298175 -0.351905 2.172947
H 0.898503 2.721548 -0.008205
H -0.887858 2.724764 -0.006019
H -2.652918 -1.985084 0.854127
H -2.655025 -1.989558 -0.837886
H 2.647275 -1.998570 -0.844409
H 2.649462 -1.994030 0.847581


