0 mol 15 unq 0 iso 0 dist 6.16274 5.00898 6.42748 6.19695 4.22652 6.31608 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 9.58693 10.8137 5.78706 5.61418 9.53244 7.54574 numMergedOcc 0
2 mol 101 unq 0 iso 0 dist 7.42893 9.31844 6.98314 8.8847 6.2696 9.44645 numMergedOcc 0
3 mol 117 unq 0 iso 0 dist 6.97244 6.85703 7.70232 5.56913 4.46691 6.5788 numMergedOcc 0
4 mol 117 unq 1 iso 0 dist 6.97244 9.39186 7.4671 5.56913 4.46691 6.2771 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 9.06272 6.48813 6.28565 5.5917 10.3933 8.98175 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 9.13451 4.14325 5.62052 12.5878 3.78012 8.72359 numMergedOcc 0
7 mol 135 unq 1 iso 0 dist 9.13451 4.14325 5.62052 5.60595 10.9403 7.02963 numMergedOcc 0
8 mol 135 unq 2 iso 0 dist 9.171 4.14325 7.85645 12.5878 9.62654 8.72359 numMergedOcc 0
9 mol 135 unq 3 iso 0 dist 9.171 4.14325 7.85645 5.60595 8.06169 7.02963 numMergedOcc 0
10 mol 146 unq 0 iso 0 dist 8.74283 4.50898 8.84535 10.0909 10.4935 5.95148 numMergedOcc 0
11 mol 182 unq 0 iso 0 dist 6.32172 5.41536 7.09394 6.78641 6.45169 9.98182 numMergedOcc 0
12 mol 182 unq 1 iso 0 dist 6.32172 5.41536 7.09394 10.863 6.1548 9.02127 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 9.14351 5.56847 5.48118 5.3865 10.3504 8.76518 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.26503 5.62207 9.96262 11.6634 8.21389 9.36974 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 9.80417 5.62207 7.21311 11.6634 11.9728 9.36974 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 8.62414 10.5063 8.00673 15.4203 13.7796 8.1769 numMergedOcc 0
17 mol 278 unq 1 iso 0 dist 8.62414 10.5063 8.00673 11.42 10.2359 7.1656 numMergedOcc 0
18 mol 278 unq 2 iso 0 dist 6.23184 10.5063 6.62841 15.4203 9.26354 8.1769 numMergedOcc 0
19 mol 278 unq 3 iso 0 dist 6.23184 10.5063 6.62841 11.42 5.33325 7.1656 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 7.47799 11.4465 9.76787 10.3884 4.51188 9.47429 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 6.87804 13.9059 7.07965 12.5048 7.22011 5.91617 numMergedOcc 0
22 mol 292 unq 1 iso 0 dist 6.07571 4.59906 7.07965 4.97488 7.22011 5.91617 numMergedOcc 0
