0 mol 1 unq 0 iso 0 dist 9.34725 7.68779 11.5373 4.86523 12.6842 6.86701 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.30501 7.68779 4.58277 4.86523 10.3005 6.86701 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 9.8917 6.89185 9.15854 6.12049 14.3721 8.65848 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 9.8917 6.89185 9.15854 4.94803 12.8028 7.25801 numMergedOcc 0
4 mol 86 unq 0 iso 0 dist 8.8236 5.49793 7.89966 5.96801 12.6468 7.90423 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 9.48297 8.89514 10.592 4.11658 11.6898 6.53308 numMergedOcc 0
6 mol 89 unq 1 iso 0 dist 9.48297 8.89514 10.592 10.0938 15.8926 7.47974 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.75977 8.22406 9.54167 4.57682 10.9777 9.36001 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 9.93751 7.63658 14.2013 7.35282 15.3455 9.05166 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 9.93751 7.63658 14.2013 8.43423 15.2631 5.56994 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.98949 6.38977 7.47571 4.67452 13.3729 9.27976 numMergedOcc 0
11 mol 132 unq 0 iso 0 dist 8.58873 9.0339 5.28089 3.48657 8.40461 6.89918 numMergedOcc 0
12 mol 132 unq 1 iso 0 dist 8.58873 8.48641 4.50065 3.48657 8.40461 7.89457 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 8.68179 6.64164 7.9092 5.02648 11.5101 7.20495 numMergedOcc 0
14 mol 167 unq 1 iso 0 dist 8.68179 6.64164 7.9092 12.0503 17.0097 9.2289 numMergedOcc 0
15 mol 167 unq 2 iso 0 dist 8.68179 6.64164 7.9092 10.1276 14.3642 7.02548 numMergedOcc 0
16 mol 167 unq 3 iso 0 dist 5.32056 6.64164 6.45463 5.02648 9.41209 7.20495 numMergedOcc 0
17 mol 167 unq 4 iso 0 dist 5.32056 6.64164 6.45463 12.0503 14.8848 9.2289 numMergedOcc 0
18 mol 167 unq 5 iso 0 dist 5.32056 6.64164 6.45463 10.1276 12.7968 7.02548 numMergedOcc 0
19 mol 167 unq 6 iso 0 dist 7.35339 9.73922 5.74656 6.35125 9.47168 7.68266 numMergedOcc 0
20 mol 167 unq 7 iso 0 dist 7.35339 9.73922 5.74656 8.80332 9.76579 6.84752 numMergedOcc 0
21 mol 167 unq 8 iso 0 dist 9.52659 6.64164 6.67469 5.02648 11.1897 7.20495 numMergedOcc 0
22 mol 167 unq 9 iso 0 dist 9.52659 6.64164 6.67469 12.0503 9.47168 9.2289 numMergedOcc 0
23 mol 167 unq 10 iso 0 dist 9.52659 6.64164 6.67469 10.1276 9.76579 7.02548 numMergedOcc 0
24 mol 197 unq 0 iso 0 dist 9.75129 6.22696 6.04016 13.0947 12.1371 9.10817 numMergedOcc 0
25 mol 197 unq 1 iso 0 dist 9.75129 6.22696 6.04016 4.65029 13.4799 9.73548 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 6.9659 9.2521 14.301 12.95 18.2616 9.08509 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 6.9659 8.51359 15.0149 6.44649 11.6022 9.06592 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 8.09547 7.13194 13.3052 13.1414 16.205 9.72188 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 8.66923 7.62771 13.1885 14.7797 15.7988 8.82351 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 8.66923 7.80166 7.04671 6.10342 5.52788 9.72188 numMergedOcc 0
