%nprocshared=8
%mem=22GB
%chk=carbonate_Heptane.chk
#p opt=(maxstep=5) freq WB97XD 6-311G(d,p) scrf(smd,solvent=Heptane)

Auto-generated custom job for carbonate_Heptane

0 1
C  -1.022079  -0.838471  -0.070270
O  -0.376393  -1.860310  -0.131493
O  -0.508704   0.370028   0.029388
O  -2.351523  -0.897588  -0.105266
C  -3.258717   0.248364   0.016642
C  -4.628509  -0.414987  -0.065953
C  -3.066654   1.212585  -1.148842
C  -3.078994   0.924191   1.371721
H  -4.745365  -0.936822  -1.018845
H  -5.414555   0.339672   0.015867
H  -4.753685  -1.138696   0.743061
H  -3.132697   0.676129  -2.099249
H  -2.104849   1.720810  -1.096263
H  -3.859154   1.965441  -1.127338
H  -3.160429   0.186410   2.174532
H  -3.867470   1.668662   1.511271
H  -2.114424   1.424682   1.448581
H   0.503097   0.306399   0.032109
N   2.150497   0.257828   0.015044
C   2.735251  -0.941951   0.063545
C   4.113085  -1.099431   0.063310
C   4.912724   0.034431   0.008358
C   4.305892   1.282698  -0.045034
C   2.921070   1.346653  -0.038561
H   2.057140  -1.787964   0.098850
H   4.545280  -2.091314   0.105309
H   5.993249  -0.053454   0.005683
H   4.890020   2.193420  -0.090798
H   2.404913   2.300294  -0.078609


