MB spectrum	Partition	Partition Score	Mass Error	Feasibilty	% Precursor	SF1	SF2	SF3	SF4	SF5	Whole Formula	SFmass1	SFmass2	SFmass3	SFmass4	SFmass5	Compound	Pubchem CID	CE	Small Neutral Loss	Neutral Intensity	Smallest Fragment	Small Frag Intensity	over	under	over intense	Under intense	dispersion
LU131301	2	56	0.4501	6	999	C2H2O	C4H4	C3H6N3F			C9H12N3OF	42.0105	52.0313	103.0534			PCID	6051	15	93.0579	105	52.03133	55	1	3	59	141	20
LU131301	3	50	0.6437	43	999	C2H3	C4H4N	N2	C6H4		C12H11N3	27.0223	66.0355	28.0063	76.0311		PCID	6051	15	93.0579	105	52.03133	55	1	3	59	141	26
LU131301	4	49	0.1063	269	999	H3N	C2N2	C4H4	C6H4		C12H11N3	17.0267	52.0061	52.0313	76.0311		PCID	6051	15	93.0579	105	52.03133	55	1	3	59	141	49
LU131301	5	49	0.0939	298	999	N2	C6H4	C2H3N	C4H4		C12H11N3	28.0063	76.0311	41.0265	52.0313		PCID	6051	15	93.0579	105	52.03133	55	1	3	59	141	26
LU131301	6	48	0.5500	5	999	H2O	C6H4	C3H6N3F			C9H12N3OF	18.0107	76.0311	103.0534			PCID	6051	15	93.0579	105	52.03133	55	1	3	59	141	11
LU131301	7	45	0.0667	330	999	C2N2	C4H4	C6H7N			C12H11N3	52.0061	52.0313	93.0578			PCID	6051	15	93.0579	105	52.03133	55	1	3	59	141	38