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view test-data/out_sum_test03.tabular @ 2:1276908e8fc4 draft

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Master branch Updating - - Fxx
author fgiacomoni
date Mon, 20 Aug 2018 09:17:05 -0400
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MASS	CLUSTER_DELTA	CLUSTER_FORMULA	CLUSTER_NAME	CLUSTER_TOTAL
521.347724	-0.00	C26H52NO7P	PC_18:1	6
521.347724	-0.00	C26H52NO7P	PC_18:1[rac]	1
521.347724	-0.00	C26H52NO7P	PC-O_18:1	1
521.347724	-0.00	C26H52NO7P	LysoPC(18:1(11Z))	1
521.347724	-0.00	C26H52NO7P	PC-P_18:0	1
507.368724	-0.00	C26H54NO6P	PC-O_18:1	3
507.368724	-0.00	C26H54NO6P	PC-P_18:0	1
507.368724	-0.04	C25H50NO7P	PC_17:1	2
479.310724	-0.01	C23H46NO7P	PC_15:1	1
479.310724	0.03	C24H50NO6P	PC-O_16:1	4
479.310724	0.03	C24H50NO6P	PC-P_16:0	1
567.331724	0.00	C30H50NO7P	PC_22:6	1