# GMTKN55, subset MCONF
# Geometries, charges and spins extraced from GMTKN archive
"1": 1.xyz
"10": 10.xyz
"11": 11.xyz
"12": 12.xyz
"13": 13.xyz
"14": 14.xyz
"15": 15.xyz
"16": 16.xyz
"17": 17.xyz
"18": 18.xyz
"19": 19.xyz
"2": 2.xyz
"20": 20.xyz
"21": 21.xyz
"22": 22.xyz
"23": 23.xyz
"24": 24.xyz
"25": 25.xyz
"26": 26.xyz
"27": 27.xyz
"28": 28.xyz
"29": 29.xyz
"3": 3.xyz
"30": 30.xyz
"31": 31.xyz
"32": 32.xyz
"33": 33.xyz
"34": 34.xyz
"35": 35.xyz
"36": 36.xyz
"37": 37.xyz
"38": 38.xyz
"39": 39.xyz
"4": 4.xyz
"40": 40.xyz
"41": 41.xyz
"42": 42.xyz
"43": 43.xyz
"44": 44.xyz
"45": 45.xyz
"46": 46.xyz
"47": 47.xyz
"48": 48.xyz
"49": 49.xyz
"5": 5.xyz
"50": 50.xyz
"51": 51.xyz
"52": 52.xyz
"6": 6.xyz
"7": 7.xyz
"8": 8.xyz
"9": 9.xyz