0 mol 10 unq 0 iso 0 dist 8.44864 15.2726 9.88507 4.87706 9.43029 12.8824 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 9.25493 8.18351 9.52857 3.92728 9.90835 11.7488 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 5.19544 8.9488 8.37378 5.61111 6.23015 4.64441 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 7.4518 13.8263 9.52206 3.91263 7.28831 11.819 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 7.4518 4.1947 8.69945 3.91263 7.28831 4.85981 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 9.1687 9.45097 8.77074 3.91263 9.71411 6.38065 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 6.03154 7.5191 8.73383 5.94952 9.59437 4.6853 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 9.86988 5.51852 9.7113 4.45029 6.34626 6.31483 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 5.60184 3.82471 8.60004 5.18463 8.71789 7.59527 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 6.95568 3.97959 8.90567 7.62237 9.88897 4.6383 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.07527 12.93 9.2933 9.00952 8.12266 15.7604 numMergedOcc 0
11 mol 181 unq 2 iso 0 dist 9.07527 12.93 9.2933 8.32063 9.43306 9.35605 numMergedOcc 0
12 mol 181 unq 3 iso 0 dist 9.07527 12.93 9.2933 7.88733 8.59681 5.66304 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 6.32097 4.74145 5.75839 5.06821 9.23863 4.4227 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 8.37813 4.24722 5.91739 5.45156 6.15635 4.58625 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 9.14116 9.25402 5.91739 4.88971 6.15635 4.58625 numMergedOcc 0
16 mol 273 unq 0 iso 0 dist 6.38341 3.92089 9.16554 3.80794 7.85836 5.53908 numMergedOcc 0
17 mol 273 unq 1 iso 0 dist 6.38341 3.92089 9.16554 5.19474 6.35532 8.8839 numMergedOcc 0
18 mol 273 unq 2 iso 0 dist 6.38341 9.51983 9.65597 3.80794 7.85836 11.7146 numMergedOcc 0
19 mol 273 unq 3 iso 0 dist 6.38341 9.51983 9.65597 5.19474 6.35532 7.90253 numMergedOcc 0
20 mol 273 unq 4 iso 0 dist 9.78826 3.92089 8.83491 13.255 5.61969 12.7125 numMergedOcc 0
21 mol 273 unq 5 iso 0 dist 9.78826 12.0094 9.02711 13.255 5.61969 10.8576 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.60049 10.3798 9.5144 7.45665 8.6233 16.7232 numMergedOcc 0
