# 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	1.958361791e-06	3.488664409e-06	-5.834537369e-16	9.408753388e-05	0.0001676093929	-2.803145133e-14	2	3	
2	H	6.083	4.9998	5	-9.551863799e-06	-7.797612115e-08	1.764267247e-15	-3.851311484e-05	-3.143997205e-07	7.113525541e-15	1	0	
3	H	4.639	6.0208	5	5.136900187e-06	6.031625326e-07	1.780595646e-15	2.071198155e-05	2.431951331e-06	7.179361647e-15	1	0	
4	H	4.639	4.4898	5.884	-9.460119121e-06	-2.104748816e-05	2.587154955e-05	-3.81432003e-05	-8.486347224e-05	0.0001043140878	1	0	
5	H	4.639	4.4898	4.116	-9.460119121e-06	-2.104748816e-05	-2.587154955e-05	-3.81432003e-05	-8.486347224e-05	-0.0001043140878	1	0