PSF CHEQ EXT XPLOR 1 !NTITLE 11 !NATOM 1 SYS 1 MOL C1 C3LTU 0.121900 12.0100 2 SYS 1 MOL O1 OSLTU -0.403400 16.0000 3 SYS 1 MOL C2 CLTU 0.590100 12.0100 4 SYS 1 MOL O2 OLTU -0.467900 16.0000 5 SYS 1 MOL C3 C3LTU 0.605700 12.0100 6 SYS 1 MOL F1 FLTU -0.212100 19.0000 7 SYS 1 MOL F2 FLTU -0.212100 19.0000 8 SYS 1 MOL F3 FLTU -0.212100 19.0000 9 SYS 1 MOL H1 H1LTU 0.063300 1.0080 10 SYS 1 MOL H2 H1LTU 0.063300 1.0080 11 SYS 1 MOL H3 H1LTU 0.063300 1.0080 10 !NBOND: bonds 1 2 2 3 3 4 3 5 5 6 5 7 5 8 1 9 1 10 1 11 16 !NTHETA: angles 1 2 3 2 3 4 2 3 5 3 5 6 3 5 7 3 5 8 4 3 5 6 5 7 6 5 8 7 5 8 2 1 9 2 1 10 2 1 11 9 1 10 9 1 11 10 1 11 11 !NPHI: dihedrals 1 2 3 4 1 2 3 5 2 3 5 6 2 3 5 7 2 3 5 8 4 3 5 6 4 3 5 7 4 3 5 8 9 1 2 3 10 1 2 3 11 1 2 3 1 !NIMPHI: impropers 5 4 3 2 0 !NDON: donors 0 !NACC: acceptors 0 !NNB 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 0 0 !NUMLP NUMLPH 0 !NCRTERM: cross-terms