0 mol 11 unq 0 iso 0 dist 9.76233 8.44193 4.79838 13.4378 9.81983 7.5901 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 7.32472 6.68767 9.56614 7.57532 7.37118 5.48936 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 7.61514 12.3084 5.61151 15.3449 9.13593 5.75469 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 8.21116 12.3084 6.54289 15.3449 8.25144 5.75469 numMergedOcc 0
4 mol 85 unq 2 iso 0 dist 8.21116 15.5542 7.52869 15.3449 8.25144 7.66862 numMergedOcc 0
5 mol 85 unq 3 iso 0 dist 8.21116 16.0243 9.18945 15.3449 8.25144 11.7978 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.98861 6.94038 6.18681 9.37937 8.61893 4.48233 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 5.52904 7.88117 6.18681 7.6026 8.61893 4.48233 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 9.91021 8.1142 8.86956 13.6412 8.98175 6.6028 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 5.5917 4.90946 8.86956 6.48813 8.98175 6.6028 numMergedOcc 0
10 mol 135 unq 0 iso 0 dist 6.08242 12.7075 9.94534 4.75453 7.02963 11.52 numMergedOcc 0
11 mol 135 unq 1 iso 0 dist 5.60595 8.30838 9.94534 4.14325 7.02963 11.52 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 5.55632 5.33656 5.97134 6.71173 8.90588 4.70993 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.89804 6.55937 6.24036 9.20077 5.25762 4.47395 numMergedOcc 0
14 mol 193 unq 0 iso 0 dist 9.28442 6.21288 6.17074 14.5516 9.9042 8.68853 numMergedOcc 0
15 mol 193 unq 1 iso 0 dist 9.28442 6.21288 6.17074 11.2251 6.21262 5.97706 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 5.33278 4.91827 5.30187 5.72956 4.52405 4.73121 numMergedOcc 0
17 mol 281 unq 0 iso 0 dist 8.78416 13.4831 9.94612 13.7467 6.18742 14.9634 numMergedOcc 0
18 mol 281 unq 1 iso 0 dist 7.82358 6.93582 9.94612 12.8593 6.18742 14.9634 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 4.97488 7.66483 9.10627 4.59906 5.91617 9.06235 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 8.80146 5.28576 9.10627 5.59939 5.91617 9.06235 numMergedOcc 0
