@@ -49,15 +49,15 @@ def test_co_basics():
4949 assert tbl ['Q1' ][10 ] == 11
5050 assert tbl ['Q7' ][10 ] == 10
5151 assert tbl ['MOLWT' ][0 ] == 28
52- assert tbl ['TAG' ][0 ] == 28503
52+ assert tbl ['TAG' ][0 ] == - 28503
5353
5454
5555@pytest .mark .remote_data
5656def test_ch3cn_negqn ():
5757 tbl = CDMS .get_molecule ('041501' )
5858 fourtominusthree = tbl [(tbl ['Q1' ] == 4 ) & (tbl ['Q2' ] == - 3 )]
5959 assert len (fourtominusthree ) >= 1
60- assert tbl ['TAG' ][0 ] == 41501
60+ assert tbl ['TAG' ][0 ] == - 41501
6161
6262
6363@pytest .mark .remote_data
@@ -103,16 +103,16 @@ def test_molecule_with_parens():
103103
104104 MC = np .ma .core .MaskedConstant ()
105105
106- for col , val in zip (tbl [0 ].colnames , (232588.7246 , 0.2828 , - 4.1005 , 3 , 293.8540 , 445 , 66 ,
107- 506 , 303 , 44 , 14 , 30 , MC , MC , MC , 45 , 13 , 33 , MC , MC , MC , 'H2C(CN)2' , False )):
106+ for col , val in zip (tbl [0 ].colnames , (232588.7246 , 0.2828 , - 4.1005 , 3 , 293.8540 , 445 , 66506 ,
107+ 303 , 44 , 14 , 30 , MC , MC , MC , 45 , 13 , 33 , MC , MC , MC , 'H2C(CN)2' , 66 , False )):
108108 if val is MC :
109109 assert tbl [0 ][col ].mask
110110 else :
111111 assert tbl [0 ][col ] == val
112112
113113 # this test row includes degeneracy = 1225, which covers one of the weird letter-is-number parser cases
114- for col , val in zip (tbl [16 ].colnames , (233373.369 , 10.26 , - 4.8704 , 3 , 1229.0674 , 1125 , 66 ,
115- 506 , 303 , 112 , 10 , 102 , MC , MC , MC , 112 , 9 , 103 , MC , MC , MC , 'H2C(CN)2' , False ),):
114+ for col , val in zip (tbl [16 ].colnames , (233373.369 , 10.26 , - 4.8704 , 3 , 1229.0674 , 1125 , 66506 ,
115+ 303 , 112 , 10 , 102 , MC , MC , MC , 112 , 9 , 103 , MC , MC , MC , 'H2C(CN)2' , 66 , False ),):
116116 if val is MC :
117117 assert tbl [16 ][col ].mask
118118 else :
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