0 mol 13 unq 0 iso 0 dist 9.06861 8.66515 3.35815 11.6667 10.95 8.59991 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 8.74311 6.76158 4.50098 11.2165 11.6161 8.96154 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 8.74311 7.423 8.14695 11.2165 11.6161 8.90935 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.61052 4.74574 6.84869 7.87554 10.6052 7.54389 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 9.36203 8.1717 4.85685 4.66383 6.93243 5.83263 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 7.09826 5.52904 6.8994 10.3957 15.704 9.33968 numMergedOcc 0
6 mol 176 unq 0 iso 0 dist 9.25815 9.5668 4.53563 14.153 7.71329 5.60333 numMergedOcc 0
7 mol 176 unq 1 iso 0 dist 9.21292 9.5668 9.0725 14.153 14.5513 5.60333 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 9.09552 8.19926 3.98361 15.9745 13.0035 9.64977 numMergedOcc 0
9 mol 211 unq 0 iso 0 dist 9.05403 7.78316 12.8384 3.83887 11.0353 9.08278 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 4.42722 7.39043 6.47265 8.2608 6.24316 8.15802 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 5.73488 7.22151 8.58432 9.53654 14.5155 9.57433 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 7.62034 8.32786 4.01942 3.55894 7.08055 8.69082 numMergedOcc 0
13 mol 236 unq 1 iso 0 dist 7.62034 5.09952 11.0805 3.55894 7.08055 8.2521 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.70984 8.86773 11.5209 6.84145 12.9742 5.3772 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 8.70984 8.86773 11.5209 17.1265 18.4726 8.70007 numMergedOcc 0
16 mol 258 unq 2 iso 0 dist 8.70984 8.95095 15.8746 6.84145 12.9742 7.59138 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 9.53507 8.71708 3.47973 4.91539 7.11792 4.76359 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 9.24084 8.88717 6.4415 3.62492 7.06369 7.8605 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 7.03138 9.84651 6.4415 3.93543 7.06369 7.8605 numMergedOcc 0
