#p B3LYP/aug-cc-pVDZ massage SCRF=(PCM,Solvent=water) GFInput IOP(6/7=3)
 
cytidine
 
0 1
7     -0.614084   -0.186888    0.011362
6     -1.009008   -1.476391    0.143750
7     -2.260262   -1.948689    0.157137
6     -3.167632   -0.968505    0.018030
6     -2.910866    0.397940   -0.127470
6     -1.550338    0.782228   -0.127390
7     -4.093637    1.118214   -0.246082
6     -5.036342    0.204759   -0.173606
7     -4.537673   -1.072857   -0.013650
8     -0.057670   -2.404332    0.278503
7     -1.156539    2.063043   -0.258918
1      1.172563    0.345113    0.008464
1     -6.103245    0.391861   -0.228662
1     -5.080706   -1.923048    0.064841
1     -1.858193    2.780491   -0.361941
1     -0.167810    2.324809   -0.256961
7      2.188426    0.576949    0.014978
6      3.033618   -0.499871    0.163130
7      4.380170   -0.182581    0.170588
6      4.838647    1.103283    0.040699
6      3.990524    2.151807   -0.104341
6      2.562487    1.904230   -0.122250
7      2.532512   -1.688339    0.280734
8      1.691018    2.780737   -0.248679
1      5.044344   -0.938432    0.276847
1      5.920368    1.215822    0.062698
1      4.355717    3.168441   -0.206931
1      3.243647   -2.408340    0.384489
1      0.884627   -2.031288    0.266521

12 Nuc 0.0
17 Nuc 0.0
18 Nuc 0.0
19 Nuc 0.0
20 Nuc 0.0
21 Nuc 0.0
22 Nuc 0.0
23 Nuc 0.0
24 Nuc 0.0
25 Nuc 0.0
26 Nuc 0.0
27 Nuc 0.0
28 Nuc 0.0