PSF CHEQ EXT XPLOR 1 !NTITLE 12 !NATOM 1 SYS 1 MOL C1 C3LTU -0.141200 12.0100 2 SYS 1 MOL C2 C3LTU 0.111000 12.0100 3 SYS 1 MOL H1 H1LTU 0.071900 1.0080 4 SYS 1 MOL C3 C3LTU 0.634500 12.0100 5 SYS 1 MOL F1 FLTU -0.232700 19.0000 6 SYS 1 MOL F2 FLTU -0.232700 19.0000 7 SYS 1 MOL F3 FLTU -0.232700 19.0000 8 SYS 1 MOL O1 OHLTU -0.584400 16.0000 9 SYS 1 MOL H2 HCLTU 0.062500 1.0080 10 SYS 1 MOL H3 HCLTU 0.062500 1.0080 11 SYS 1 MOL H4 HCLTU 0.062500 1.0080 12 SYS 1 MOL H5 HOLTU 0.418700 1.0080 11 !NBOND: bonds 1 2 2 4 2 8 4 5 4 6 4 7 1 9 1 10 1 11 2 3 8 12 19 !NTHETA: angles 1 2 4 1 2 8 2 4 5 2 4 6 2 4 7 4 2 8 5 4 6 5 4 7 6 4 7 1 2 3 2 1 9 2 1 10 2 1 11 2 8 12 3 2 4 3 2 8 9 1 10 9 1 11 10 1 11 21 !NPHI: dihedrals 1 2 4 5 1 2 4 6 1 2 4 7 5 4 2 8 6 4 2 8 7 4 2 8 1 2 8 12 9 1 2 3 10 1 2 3 11 1 2 3 3 2 4 5 3 2 4 6 3 2 4 7 3 2 8 12 9 1 2 4 10 1 2 4 11 1 2 4 4 2 8 12 9 1 2 8 10 1 2 8 11 1 2 8 0 !NIMPHI: impropers 0 !NDON: donors 0 !NACC: acceptors 0 !NNB 0 0 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 1 1 0 0 !NUMLP NUMLPH 0 !NCRTERM: cross-terms