0 mol 54 unq 0 iso 0 dist 6.14538 7.41262 6.32568 7.15034 5.27979 3.5863 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 5.78706 11.6864 9.07676 9.53244 7.54574 11.6014 numMergedOcc 0
2 mol 98 unq 1 iso 0 dist 7.23884 4.85557 9.07676 9.91282 7.54574 11.6014 numMergedOcc 0
3 mol 98 unq 2 iso 0 dist 5.59328 11.7112 9.07676 6.54016 7.54574 11.6014 numMergedOcc 0
4 mol 98 unq 3 iso 0 dist 7.5242 6.63199 9.07676 11.2206 7.54574 11.6014 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 8.10291 15.1813 7.90709 8.76709 4.92382 11.8161 numMergedOcc 0
6 mol 141 unq 1 iso 0 dist 9.87644 6.61953 6.0262 6.80544 9.62774 8.99049 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 9.91993 6.55924 9.87021 4.73245 9.17462 10.2714 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 9.91993 6.55924 9.87021 11.5545 8.74878 14.6641 numMergedOcc 0
9 mol 148 unq 2 iso 0 dist 9.99156 11.3247 9.87021 5.38701 9.17462 10.2714 numMergedOcc 0
10 mol 148 unq 3 iso 0 dist 9.99156 11.3247 9.87021 6.77599 8.74878 14.6641 numMergedOcc 0
11 mol 148 unq 4 iso 0 dist 6.22055 6.55924 7.34023 4.73245 5.75959 10.2714 numMergedOcc 0
12 mol 148 unq 5 iso 0 dist 8.18085 11.3247 7.34023 5.38701 5.75959 10.2714 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 9.96691 6.62435 9.96938 4.73768 9.01668 10.1921 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 9.96691 6.62435 9.96938 11.5728 8.74018 14.7716 numMergedOcc 0
15 mol 150 unq 2 iso 0 dist 9.8656 11.3177 9.96938 5.46333 9.01668 10.1921 numMergedOcc 0
16 mol 150 unq 3 iso 0 dist 9.8656 11.3177 9.96938 6.74495 8.74018 14.7716 numMergedOcc 0
17 mol 150 unq 4 iso 0 dist 6.14675 6.62435 7.35268 4.73768 5.4798 10.1921 numMergedOcc 0
18 mol 150 unq 5 iso 0 dist 7.94889 11.3177 7.35268 5.46333 5.4798 10.1921 numMergedOcc 0
19 mol 151 unq 0 iso 0 dist 5.93692 8.33083 7.80544 6.93455 8.1948 14.263 numMergedOcc 0
20 mol 151 unq 1 iso 0 dist 5.93692 4.8553 5.59982 6.93455 8.1948 11.1076 numMergedOcc 0
21 mol 249 unq 0 iso 0 dist 5.48118 5.40456 6.72501 10.3504 8.76518 14.5574 numMergedOcc 0
22 mol 249 unq 1 iso 0 dist 7.25858 7.02235 6.72501 10.9925 8.76518 14.5574 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 8.52587 8.93097 9.71673 12.5154 8.09181 8.81029 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 6.39866 11.2327 9.71673 4.60007 8.09181 8.81029 numMergedOcc 0
25 mol 280 unq 0 iso 0 dist 9.76787 4.83983 5.85236 4.51188 9.47429 5.34867 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 9.88863 12.6681 8.55781 9.81399 9.373 5.51026 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 7.07965 9.6563 8.22213 7.22011 5.91617 3.98487 numMergedOcc 0
