# ATOMDATA	Id	type	x=3	u=3	F=3	neighbors=2
# Box	10	0	0	0	10	0	0	0	10
1	C	5	4.9998	5	0	0	0	0	0	0	2	3	
2	H	6.083	4.9998	5	0	0	0	0	0	0	1	0	
3	H	4.639	6.0208	5	0	0	0	0	0	0	1	0	
4	H	4.639	4.4898	5.884	0	0	0	0	0	0	1	0	
5	H	4.639	4.4898	4.116	0	0	0	0	0	0	1	0	
# ATOMDATA	Id	type	x=3	u=3	F=3	neighbors=2
1	C	5	4.9998	5	1.95836e-06	3.48866e-06	-5.83454e-16	9.40875e-05	0.000167609	-2.80315e-14	2	3	
2	H	6.083	4.9998	5	-9.55186e-06	-7.79761e-08	1.76427e-15	-3.85131e-05	-3.144e-07	7.11353e-15	1	0	
3	H	4.639	6.0208	5	5.1369e-06	6.03163e-07	1.7806e-15	2.0712e-05	2.43195e-06	7.17936e-15	1	0	
4	H	4.639	4.4898	5.884	-9.46012e-06	-2.10475e-05	2.58715e-05	-3.81432e-05	-8.48635e-05	0.000104314	1	0	
5	H	4.639	4.4898	4.116	-9.46012e-06	-2.10475e-05	-2.58715e-05	-3.81432e-05	-8.48635e-05	-0.000104314	1	0