%chk=000156033.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156033

0 1
 O    2.007200       1.428200      1.2000001E-03
 O   -2.007100      -1.428500      9.9999997E-05
 O   0.2964000       2.906500      2.2000000E-03
 O  -0.2963000      -2.906700      2.3000001E-03
 N    1.594900     -0.8978000      1.4000000E-03
 N   -1.594800      0.8975000      2.2000000E-03
 C   0.2624000     -0.6128000      2.0000001E-03
 C  -0.2622000      0.6125000      2.2000000E-03
 C    2.386500      0.1246000     -6.0000003E-04
 C   -2.386600     -0.1249000      3.0000001E-04
 C    3.864600      8.9999998E-04 -1.9999999E-04
 C   -3.864800     -8.9999998E-04  3.0000001E-04
 C   0.6845000       1.742900      2.2000000E-03
 C  -0.6844000      -1.743200      2.0000001E-03
 C    4.465900      -1.261000      2.4000001E-03
 C   -4.465800       1.261100      2.2000000E-03
 C    4.665400       1.146600     -3.8999999E-03
 C   -4.665700      -1.146500     -3.1999999E-03
 C    5.856000      -1.376200      1.1000000E-03
 C   -5.855800       1.376700      3.9999999E-04
 C    6.055500       1.031400     -5.2999998E-03
 C   -6.055900      -1.030900     -5.1000002E-03
 C    6.650800     -0.2301000     -2.9000000E-03
 C   -6.650900      0.2306000     -3.1999999E-03
 H    3.870100      -2.170000      5.2000000E-03
 H   -3.869800       2.169900      4.8000002E-03
 H    4.244500       2.148100     -6.3999998E-03
 H   -4.244900      -2.148100     -5.1000002E-03
 H    6.319900      -2.358300      2.9000000E-03
 H   -6.319500       2.358900      1.7000000E-03
 H    6.675000       1.923500     -8.3999997E-03
 H   -6.675500      -1.922900     -8.0000004E-03
 H    7.733200     -0.3198000     -4.0000002E-03
 H   -7.733200      0.3205000     -4.6999999E-03


%chk=000156033-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156033

0 1
O 2.012727 1.505570 0.000801
O -2.012750 -1.505466 0.000698
O 0.272213 3.030663 -0.000116
O -0.272236 -3.030557 0.000799
N 1.659509 -0.872732 0.001161
N -1.659531 0.872837 0.000409
C 0.294881 -0.642085 0.000833
C -0.294904 0.642190 0.000580
C 2.471460 0.171634 0.001788
C -2.471484 -0.171529 0.000832
C 3.933008 0.044939 0.000280
C -3.933033 -0.044833 -0.000262
C 0.581677 1.836712 0.000320
C -0.581699 -1.836607 0.000682
C 4.509669 -1.257010 -0.000598
C -4.509693 1.257116 -0.001099
C 4.771373 1.194198 -0.000474
C -4.771397 -1.194093 -0.000572
C 5.909399 -1.402317 -0.001857
C -5.909423 1.402425 -0.002049
C 6.171338 1.037729 -0.001736
C -6.171362 -1.037623 -0.001529
C 6.743676 -0.257201 -0.002450
C -6.743700 0.257307 -0.002276
H 3.844007 -2.125445 -0.000040
H -3.844030 2.125551 -0.000855
H 4.318528 2.189643 0.000134
H -4.318551 -2.189537 0.000040
H 6.352632 -2.403494 -0.002380
H -6.352655 2.403601 -0.002612
H 6.817267 1.921889 -0.002167
H -6.817292 -1.921782 -0.001689
H 7.833040 -0.373753 -0.003461
H -7.833064 0.373858 -0.003032


