DC=FALSE SCC=(THIRDFULL=TRUE DAMPXH=TRUE DAMPXHZETA=4.0 LC=false ECONV=1e-06 DCONV=1e-06) DCDFTB input generated from CMMDE code 2 N 2 -0.1535 N-N.skf N-H.skf H 1 -0.1857 H-N.skf H-H.skf 4 0 1 N -3.92638 2.02046 -0.01511 H -2.88327 2.03305 0.00110 H -4.26440 3.00059 -0.13170 H -4.26440 1.66429 0.90542