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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Mar-2025	picarbutrazox_E_CONF227_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.97071860; Eh
	23-Mar-2025	picarbutrazox_E_CONF237_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.97103805; Eh
	23-Mar-2025	picarbutrazox_E_CONF224_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.97074053; Eh
	23-Mar-2025	picarbutrazox_E_CONF231_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.97252100; Eh
	23-Mar-2025	picarbutrazox_E_CONF232_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.97257781; Eh
	23-Mar-2025	picarbutrazox_E_CONF223_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.97262502; Eh
	23-Mar-2025	picarbutrazox_E_CONF239_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.97088250; Eh
	23-Mar-2025	picarbutrazox_E_CONF244_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.96660334; Eh
	23-Mar-2025	picarbutrazox_E_CONF245_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.96634900; Eh
	23-Mar-2025	picarbutrazox_E_CONF243_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	DFT	def2-TZVPP; def2/J	-1384.96631664; Eh

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