0 mol 20 unq 0 iso 0 dist 8.36009 10.4916 7.5517 12.1601 8.26091 5.45273 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.42968 8.65417 8.56274 4.30555 8.25818 6.79749 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 7.39066 15.9289 9.41425 7.16919 8.28202 14.8703 numMergedOcc 0
3 mol 107 unq 0 iso 0 dist 7.09988 6.04612 7.82303 7.96442 8.88124 12.8715 numMergedOcc 0
4 mol 107 unq 1 iso 0 dist 7.09988 6.04612 7.82303 14.3565 8.19484 13.2648 numMergedOcc 0
5 mol 107 unq 2 iso 0 dist 7.73898 8.46075 7.82303 6.37998 8.88124 12.8715 numMergedOcc 0
6 mol 107 unq 3 iso 0 dist 7.73898 8.46075 7.82303 11.5335 8.19484 13.2648 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 7.12662 5.6183 7.12765 9.10228 7.76123 4.21194 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 9.38 5.6183 6.28471 9.10228 6.08651 4.21194 numMergedOcc 0
9 mol 193 unq 0 iso 0 dist 8.29723 10.6728 7.06636 14.1573 8.30069 10.128 numMergedOcc 0
10 mol 193 unq 1 iso 0 dist 8.29723 10.6728 7.06636 13.7342 8.83551 6.936 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 9.32969 10.2936 5.13892 7.35757 5.10542 8.68259 numMergedOcc 0
12 mol 194 unq 1 iso 0 dist 9.32969 5.29486 8.2232 7.35757 5.10542 9.38176 numMergedOcc 0
13 mol 250 unq 0 iso 0 dist 6.83662 12.2307 7.5999 12.1616 9.81716 6.28121 numMergedOcc 0
14 mol 250 unq 1 iso 0 dist 6.83662 9.35239 7.1454 12.1616 9.81716 5.9873 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 5.33881 7.23798 9.25019 12.1108 8.62655 11.3153 numMergedOcc 0
16 mol 260 unq 1 iso 0 dist 5.33881 7.10009 4.64695 12.1108 8.62655 5.42399 numMergedOcc 0
17 mol 268 unq 0 iso 0 dist 8.24792 6.66096 9.17515 7.87564 9.52476 10.4652 numMergedOcc 0
