PSF CHEQ EXT XPLOR 1 !NTITLE 10 !NATOM 1 SYS 1 MOL C1 C3LTU -0.112400 12.0100 2 SYS 1 MOL C2 C3LTU -0.073600 12.0100 3 SYS 1 MOL N1 NOLTU 0.226100 14.0100 4 SYS 1 MOL O1 OLTU -0.210300 16.0000 5 SYS 1 MOL O2 OLTU -0.210300 16.0000 6 SYS 1 MOL H1 HCLTU 0.064100 1.0080 7 SYS 1 MOL H2 HCLTU 0.064100 1.0080 8 SYS 1 MOL H3 HCLTU 0.064100 1.0080 9 SYS 1 MOL H4 H1LTU 0.094100 1.0080 10 SYS 1 MOL H5 H1LTU 0.094100 1.0080 9 !NBOND: bonds 1 2 2 3 3 4 3 5 1 6 1 7 1 8 2 9 2 10 15 !NTHETA: angles 1 2 3 2 3 4 2 3 5 4 3 5 1 2 9 1 2 10 2 1 6 2 1 7 2 1 8 3 2 9 3 2 10 6 1 7 6 1 8 7 1 8 9 2 10 15 !NPHI: dihedrals 1 2 3 4 1 2 3 5 6 1 2 3 7 1 2 3 8 1 2 3 4 3 2 9 4 3 2 10 5 3 2 9 5 3 2 10 6 1 2 9 6 1 2 10 7 1 2 9 7 1 2 10 8 1 2 9 8 1 2 10 0 !NIMPHI: impropers 0 !NDON: donors 0 !NACC: acceptors 0 !NNB 0 0 0 0 0 0 0 0 0 0 1 0 !NGRP NST2 0 1 0 1 !MOLNT 1 1 1 1 1 1 1 1 1 1 0 0 !NUMLP NUMLPH 0 !NCRTERM: cross-terms