0 mol 15 unq 0 iso 0 dist 9.11751 8.37378 6.19131 6.78983 9.29358 5.89412 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 9.11751 8.37378 6.19131 9.50843 10.2062 7.07399 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 9.88998 9.81761 6.81059 4.43881 10.251 7.12365 numMergedOcc 0
3 mol 30 unq 1 iso 0 dist 9.88998 9.81761 6.81059 9.17153 13.2257 8.1284 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 7.7933 5.94373 6.90629 7.26966 11.9355 9.97159 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 9.50776 6.52844 6.6028 6.13737 11.8081 6.28565 numMergedOcc 0
6 mol 181 unq 0 iso 0 dist 9.23089 9.2933 5.60306 5.32364 6.93764 5.9176 numMergedOcc 0
7 mol 181 unq 1 iso 0 dist 9.23089 8.77781 6.05477 13.9725 11.4148 9.39829 numMergedOcc 0
8 mol 181 unq 2 iso 0 dist 9.23089 8.77781 6.05477 5.32364 6.93764 6.41453 numMergedOcc 0
9 mol 181 unq 3 iso 0 dist 7.39743 7.08557 5.35588 5.38569 7.37327 5.94469 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.46024 8.91143 13.1178 11.3133 17.9359 7.66165 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 9.40031 9.854 4.65391 9.70055 9.45278 6.95086 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 8.64747 8.99878 5.2908 5.54495 7.39747 9.01021 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 5.91933 8.99878 5.91881 5.54495 8.1777 9.01021 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.77741 7.87648 10.4122 14.0618 19.7464 9.63959 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 9.77741 7.87648 10.4122 6.96581 13.4366 9.96262 numMergedOcc 0
16 mol 258 unq 2 iso 0 dist 9.77741 7.87648 10.4122 5.38982 12.5439 7.21311 numMergedOcc 0
17 mol 271 unq 0 iso 0 dist 8.6344 6.85471 4.51983 5.49799 11.1285 9.70714 numMergedOcc 0
