0 mol 28 unq 0 iso 0 dist 8.43134 8.76563 6.75443 12.2207 9.77719 14.8033 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.43134 15.1628 9.02508 12.2207 9.77719 14.2352 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 8.43134 13.148 8.44081 12.2207 9.77719 6.51818 numMergedOcc 0
3 mol 96 unq 0 iso 0 dist 7.93114 8.19733 7.97907 5.30464 9.4816 4.475 numMergedOcc 0
4 mol 96 unq 1 iso 0 dist 9.56302 10.7246 7.97907 9.18545 9.4816 4.475 numMergedOcc 0
5 mol 132 unq 0 iso 0 dist 8.84518 8.35617 6.13054 4.04322 9.34754 10.7289 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 6.59061 4.46061 9.15274 4.6728 9.19254 8.53742 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 8.32373 5.32036 5.24705 10.4563 9.90751 6.38603 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 7.30288 11.3751 6.99973 12.1153 9.72819 7.55646 numMergedOcc 0
9 mol 228 unq 0 iso 0 dist 7.4244 5.91773 9.87391 9.17094 9.10819 5.01264 numMergedOcc 0
10 mol 228 unq 1 iso 0 dist 7.4244 12.1514 9.72673 9.17094 9.10819 12.3157 numMergedOcc 0
11 mol 228 unq 2 iso 0 dist 7.40089 4.06247 9.94292 9.36821 8.68964 12.3301 numMergedOcc 0
12 mol 228 unq 3 iso 0 dist 7.40089 9.94066 9.53671 9.36821 8.68964 5.06085 numMergedOcc 0
13 mol 228 unq 4 iso 0 dist 7.19441 12.1987 9.94292 9.22506 8.68964 12.3301 numMergedOcc 0
14 mol 228 unq 5 iso 0 dist 7.19441 6.03337 9.53671 9.22506 8.68964 5.06085 numMergedOcc 0
15 mol 228 unq 6 iso 0 dist 7.21082 9.54164 9.87391 9.20058 9.10819 5.01264 numMergedOcc 0
16 mol 228 unq 7 iso 0 dist 7.21082 4.36704 9.72673 9.20058 9.10819 12.3157 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 6.09111 6.50733 9.23318 9.7363 7.86214 10.6092 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 8.41696 8.43137 8.90779 8.89046 5.91328 10.0769 numMergedOcc 0
19 mol 243 unq 1 iso 0 dist 8.41696 8.43137 8.90779 11.6397 6.02146 9.84746 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 7.38219 8.40251 6.64026 4.88543 6.759 4.31952 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.1299 7.01799 6.75269 4.38471 7.37164 4.53492 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.1299 7.01799 6.75269 4.38471 7.37164 4.53492 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.1299 7.01799 6.75269 4.38471 7.37164 4.53492 numMergedOcc 0
