%chk=000006690.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006690

0 1
 O   -3.254400       2.140300     -1.6000000E-03
 O    3.254800      -2.140500     -4.9000001E-03
 O   -5.416600      -2.740500     -1.5000000E-03
 O    5.416300       2.740600      3.9999999E-04
 N  -0.7541000       1.145000     -3.7000000E-03
 N   0.7542000      -1.145200     -3.5999999E-03
 C   -1.443000     -8.6900003E-02 -3.3000000E-03
 C    1.443000      8.6700000E-02 -4.1000000E-03
 C   0.6513000       1.264200     -4.3000001E-03
 C  -0.6514000      -1.264400     -3.4000000E-03
 C   -2.850200     -0.1928000     -2.0000001E-03
 C    2.850200      0.1926000     -3.0000000E-03
 C   -3.441000      -1.464600     -1.0000000E-03
 C    3.440900       1.464400     -2.2000000E-03
 C    1.258800       2.519800     -3.1000001E-03
 C   -1.259000      -2.520000     -2.0999999E-03
 C   -3.726200       1.010000     -1.2000001E-03
 C    3.726300      -1.010100     -2.0999999E-03
 C   -2.647100      -2.620000     -1.2000001E-03
 C    2.647100       2.619900     -2.3000001E-03
 C   -5.194000      0.8455000      1.2000001E-03
 C    5.194200     -0.8455000      1.2000001E-03
 C   -4.911000      -1.624500      9.9999997E-05
 C    4.910900       1.624600     -3.9999999E-04
 C   -5.766000     -0.4251000      2.2000000E-03
 C    5.766000      0.4252000      2.0999999E-03
 C   -6.018400       1.978600      2.7999999E-03
 C    6.018600      -1.978400      3.5000001E-03
 C   -7.159500     -0.5668000      4.9000001E-03
 C    7.159400      0.5672000      5.2999998E-03
 C   -7.406300       1.834900      5.9000002E-03
 C    7.406500      -1.834600      6.8999999E-03
 C   -7.976000      0.5640000      6.8999999E-03
 C    7.976100     -0.5635000      7.7000000E-03
 H   -1.295900       1.998600     -5.2000000E-03
 H    1.295900      -1.998800     -4.8000002E-03
 H   0.6580000       3.425600     -2.7999999E-03
 H  -0.6582000      -3.425800     -1.9000000E-03
 H   -3.093000      -3.611400     -3.9999999E-04
 H    3.092900       3.611400     -1.4000000E-03
 H   -5.600700       2.981900      2.0999999E-03
 H    5.600900      -2.981700      3.0000000E-03
 H   -7.627800      -1.547400      5.7000001E-03
 H    7.627600       1.547900      6.0000001E-03
 H   -8.042800       2.715000      7.4000000E-03
 H    8.043000      -2.714600      8.8000000E-03
 H   -9.056400      0.4532000      9.2000002E-03
 H    9.056500     -0.4527000      1.0200000E-02


%chk=000006690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006690

0 1
O -3.143079 2.190467 0.002492
O 3.143063 -2.190394 0.001011
O -5.458874 -2.850794 0.001695
O 5.458910 2.850842 0.001442
N -0.782795 1.134891 0.001579
N 0.782814 -1.134822 0.001162
C -1.417978 -0.104383 0.001651
C 1.418000 0.104451 0.001179
C 0.603698 1.289612 0.001412
C -0.603672 -1.289544 0.001461
C -2.842240 -0.209214 0.001866
C 2.842259 0.209282 0.000977
C -3.442142 -1.519089 0.001834
C 3.442168 1.519156 0.000897
C 1.215264 2.561299 0.001366
C -1.215235 -2.561231 0.001460
C -3.672238 1.006076 0.001967
C 3.672247 -1.006017 0.001026
C -2.620706 -2.666863 0.001654
C 2.620727 2.666926 0.001081
C -5.148049 0.845443 0.000822
C 5.148055 -0.845387 0.000503
C -4.917129 -1.692049 0.002003
C 4.917157 1.692101 0.000410
C -5.749410 -0.449920 0.000819
C 5.749429 0.449969 0.000360
C -5.969988 2.002440 -0.000226
C 5.969991 -2.002395 0.000327
C -7.161770 -0.564664 -0.000230
C 7.161792 0.564700 0.000064
C -7.372281 1.876867 -0.001251
C 7.372284 -1.876828 0.000016
C -7.970283 0.588955 -0.001262
C 7.970294 -0.588925 -0.000106
H -1.456185 1.940396 0.002187
H 1.456204 -1.940325 0.001286
H 0.586958 3.458084 0.001549
H -0.586931 -3.458017 0.001338
H -3.114625 -3.643325 0.001669
H 3.114652 3.643385 0.001011
H -5.480321 2.981168 -0.000173
H 5.480323 -2.981121 0.000444
H -7.591410 -1.571615 -0.000192
H 7.591437 1.571648 -0.000068
H -8.002536 2.772699 -0.002052
H 8.002536 -2.772665 -0.000100
H -9.061515 0.493011 -0.002035
H 9.061527 -0.492978 -0.000325


