0 mol 4 unq 0 iso 0 dist 9.30799 5.65298 9.15878 6.00246 5.93454 7.64358 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 6.64844 4.76522 5.02642 5.73092 6.02472 6.70122 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 9.55654 8.00727 6.77845 13.1131 5.68212 10.4266 numMergedOcc 0
3 mol 83 unq 1 iso 0 dist 9.55654 6.0402 5.48555 13.1131 5.68212 7.34738 numMergedOcc 0
4 mol 83 unq 2 iso 0 dist 9.55654 12.2939 5.39805 13.1131 5.68212 6.63513 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 7.45361 11.3789 8.87089 4.90318 8.20319 8.09473 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 8.91952 8.25761 8.23356 10.171 9.50699 4.00529 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 8.70982 5.60511 5.82456 8.76576 8.55826 3.88006 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 5.92115 4.02665 5.16531 6.48813 6.52844 7.03404 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 8.46957 9.73438 8.17814 14.355 7.7461 10.009 numMergedOcc 0
10 mol 130 unq 1 iso 0 dist 8.46957 9.73438 8.17814 12.4939 9.53985 6.31817 numMergedOcc 0
11 mol 130 unq 2 iso 0 dist 8.46957 10.7854 9.14434 14.355 7.7461 15.9635 numMergedOcc 0
12 mol 130 unq 3 iso 0 dist 8.46957 10.7854 9.14434 12.4939 9.53985 16.1901 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.39237 6.59916 6.36789 8.69113 8.91143 4.11297 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 5.91901 14.58 9.78743 10.3365 8.29166 7.02086 numMergedOcc 0
15 mol 192 unq 1 iso 0 dist 5.91901 14.58 9.78743 9.66119 8.14859 14.0195 numMergedOcc 0
16 mol 192 unq 2 iso 0 dist 5.91901 14.58 9.78743 7.21909 5.62421 11.153 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 8.32792 11.6087 8.12934 10.0436 9.78347 4.37504 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 9.38507 4.07622 6.5622 8.64055 9.37999 5.30641 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 6.45589 5.64063 9.91128 8.64705 9.49129 12.6625 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 6.45589 5.64063 9.91128 3.99122 6.80544 6.5335 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 6.95552 7.98954 8.43002 5.62207 7.87648 10.318 numMergedOcc 0
