remark goes here MASS FU 55.0 FD 55.0 F4 55.0 S2 32.06 S3 32.06 S1 32.06 SU 32.06 SD 32.06 BOND FU-SU 60.0 2.35 FD-SD 60.0 2.35 FU-S1 82.8 2.28 FD-SU 75.3 2.22 FU-SD 75.3 2.22 FD-S1 82.8 2.28 ANGLE SU-FU-SU 7.0 107.0 SD-FD-SD 7.0 107.0 SD-FD-SU 13.0 104.5 SU-FU-SD 13.0 104.5 FD-SD-FU 10.5 73.0 FU-SU-FD 10.5 73.0 SU-FU-S1 12.1 110.0 SD-FD-S1 12.1 110.0 SD-FU-S1 12.8 120.0 SU-FD-S1 12.8 120.0 FU-SU-FU 8.5 71.3 FD-SD-FD 8.5 71.3 CT-S1-FU 18.2 104.9 CT-S1-FD 18.2 104.9 DIHE SU-FU-SU-FU 1 0.000 0.000 0.000 ATTN, need revision SD-FU-SD-FD 1 0.000 0.000 0.000 ATTN, need revision SU-FU-SD-FD 1 0.000 0.000 0.000 ATTN, need revision H1-CT-S1-FU 1 0.000 0.000 0.000 ATTN, need revision H1-CT-S1-FD 1 0.000 0.000 0.000 ATTN, need revision CT-CT-S1-FU 1 0.000 0.000 0.000 ATTN, need revision CT-CT-S1-FD 1 0.000 0.000 0.000 ATTN, need revision CT-S1-FU-SU 1 0.000 0.000 0.000 ATTN, need revision CT-S1-FD-SD 1 0.000 0.000 0.000 ATTN, need revision CT-S1-FD-SU 1 0.000 0.000 0.000 ATTN, need revision CT-S1-FU-SD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-S1-CT 1 0.000 0.000 0.000 ATTN, need revision CT-S1-FU-S1 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FU-SU-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SU-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SU-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FD-S1-CT 1 0.000 0.000 0.000 ATTN, need revision CT-S1-FD-S1 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SD-FD 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SU-FU 1 0.000 0.000 0.000 ATTN, need revision S1-FD-SU-FU 1 0.000 0.000 0.000 ATTN, need revision SD-FU-SU-FD 1 0.000 0.000 0.000 ATTN, need revision SD-FD-SD-FD 1 0.000 0.000 0.000 ATTN, need revision FD-SU-FU-SU 1 0.000 0.000 0.000 ATTN, need revision FD-SU-FU-SD 1 0.000 0.000 0.000 ATTN, need revision FD-SU-FU-SU 1 0.000 0.000 0.000 ATTN, need revision FD-SD-FD-SD 1 0.000 0.000 0.000 ATTN, need revision FD-SD-FD-SU 1 0.000 0.000 0.000 ATTN, need revision FD-SD-FD-SU 1 0.000 0.000 0.000 ATTN, need revision SD-FU-SU-FD 1 0.000 0.000 0.000 ATTN, need revision SD-FU-SU-FD 1 0.000 0.000 0.000 ATTN, need revision SD-FD-SD-FD 1 0.000 0.000 0.000 ATTN, need revision SD-FD-SD-FD 1 0.000 0.000 0.000 ATTN, need revision FU-SU-FU-SD 1 0.000 0.000 0.000 ATTN, need revision FU-SU-FD-SD 1 0.000 0.000 0.000 ATTN, need revision FU-SU-FD-SD 1 0.000 0.000 0.000 ATTN, need revision FU-SD-FD-SD 1 0.000 0.000 0.000 ATTN, need revision FU-SD-FD-SD 1 0.000 0.000 0.000 ATTN, need revision FU-SD-FD-SU 1 0.000 0.000 0.000 ATTN, need revision FU-SU-FU-SD 1 0.000 0.000 0.000 ATTN, need revision FU-SU-FD-SD 1 0.000 0.000 0.000 ATTN, need revision NONBON S1 2.0000 0.2500 W. Cornell CH3SH and CH3SCH3 FEP's FU 1.20000 0.05000 0.00000 SU 2.0000 0.2500 W. Cornell CH3SH and CH3SCH3 FEP's FD 1.20000 0.05000 0.00000 SD 2.0000 0.2500 W. Cornell CH3SH and CH3SCH3 FEP's