tetrathioperylene scsd model output

SCSD model generated from precomputed using D_2h symmetry, available as tetrathioperylene

x	y	z	at
3.5536	-1.2081	-0.0	C
2.8714	-2.4109	-0.0	C
1.4999	-2.4265	-0.0	C
0.7319	-1.2621	-0.0	C
1.4129	-0.0	-0.0	C
0.7319	1.2621	-0.0	C
1.4999	2.4265	-0.0	C
2.8714	2.4109	-0.0	C
3.5536	1.2081	-0.0	C
2.8286	-0.0	-0.0	C
-3.5536	1.2081	0.0	C
-2.8714	2.4109	0.0	C
-1.4999	2.4265	0.0	C
-0.7319	1.2621	0.0	C
-1.4129	0.0	0.0	C
-0.7319	-1.2621	0.0	C
-1.4999	-2.4265	0.0	C
-2.8714	-2.4109	0.0	C
-3.5536	-1.2081	0.0	C
-2.8286	0.0	0.0	C
5.3064	-1.0491	-0.0	S
5.3064	1.0491	-0.0	S
-5.3064	1.0491	0.0	S
-5.3064	-1.0491	0.0	S

#tetrathioperylene 20260119
model_objs_dict['tetrathioperylene'] = scsd_model('tetrathioperylene', array([['3.5536', '-1.2081', '-0.0', 'C'], ['2.8714', '-2.4109', '-0.0', 'C'], ['1.4999', '-2.4265', '-0.0', 'C'], ['0.7319', '-1.2621', '-0.0', 'C'], ['1.4129', '-0.0', '-0.0', 'C'], ['0.7319', '1.2621', '-0.0', 'C'], ['1.4999', '2.4265', '-0.0', 'C'], ['2.8714', '2.4109', '-0.0', 'C'], ['3.5536', '1.2081', '-0.0', 'C'], ['2.8286', '-0.0', '-0.0', 'C'], ['-3.5536', '1.2081', '0.0', 'C'], ['-2.8714', '2.4109', '0.0', 'C'], ['-1.4999', '2.4265', '0.0', 'C'], ['-0.7319', '1.2621', '0.0', 'C'], ['-1.4129', '0.0', '0.0', 'C'], ['-0.7319', '-1.2621', '0.0', 'C'], ['-1.4999', '-2.4265', '0.0', 'C'], ['-2.8714', '-2.4109', '0.0', 'C'], ['-3.5536', '-1.2081', '0.0', 'C'], ['-2.8286', '0.0', '0.0', 'C'], ['5.3064', '-1.0491', '-0.0', 'S'], ['5.3064', '1.0491', '-0.0', 'S'], ['-5.3064', '1.0491', '0.0', 'S'], ['-5.3064', '-1.0491', '0.0', 'S']]), 'D2h' , maxdist = 1.95, mondrian_limits = [-1.0, -1.0])