0 mol 24 unq 0 iso 0 dist 8.48944 5.42968 3.67206 14.0586 7.27472 10.551 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.48944 5.94343 8.93303 14.0586 7.27472 14.1707 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.04448 5.42968 9.24731 9.67461 5.68215 8.23075 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.04448 5.94343 3.53396 9.67461 5.68215 4.7841 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.6834 5.42968 11.1587 13.4994 7.95042 16.3188 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 6.6834 5.94343 8.72577 13.4994 7.95042 12.0986 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.74209 9.72346 5.14161 5.5249 6.6263 7.39848 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 8.74209 9.72346 5.14161 10.4413 6.75943 11.4251 numMergedOcc 0
8 mol 43 unq 2 iso 0 dist 9.85555 7.45173 5.14161 5.46715 6.6263 7.39848 numMergedOcc 0
9 mol 43 unq 3 iso 0 dist 9.85555 7.45173 5.14161 12.902 6.75943 11.4251 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 8.57607 8.6356 8.96713 4.16047 8.27883 11.8859 numMergedOcc 0
11 mol 95 unq 1 iso 0 dist 8.57607 8.6356 8.96713 8.68514 7.7152 12.726 numMergedOcc 0
12 mol 95 unq 2 iso 0 dist 6.1991 8.6356 10.6694 4.16047 5.75428 11.8859 numMergedOcc 0
13 mol 95 unq 3 iso 0 dist 5.96246 8.6356 10.3539 4.16047 8.57395 11.8859 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 8.33147 9.98096 4.56877 4.59843 8.97589 11.0396 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 8.33147 8.24035 6.68311 4.59843 8.97589 9.84566 numMergedOcc 0
16 mol 184 unq 2 iso 0 dist 8.33147 8.77932 3.88698 4.59843 8.97589 8.22001 numMergedOcc 0
17 mol 184 unq 3 iso 0 dist 8.09403 9.98096 8.73 4.59843 5.96423 11.0396 numMergedOcc 0
18 mol 184 unq 4 iso 0 dist 8.09403 8.24035 9.71065 4.59843 5.96423 9.84566 numMergedOcc 0
19 mol 184 unq 5 iso 0 dist 8.09403 8.77932 3.30691 4.59843 5.96423 8.22001 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 6.04336 9.6283 5.4547 4.70216 9.3498 12.5081 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 6.04336 9.6283 5.4547 6.13422 7.05695 6.93931 numMergedOcc 0
22 mol 186 unq 2 iso 0 dist 9.00537 9.6283 8.85948 11.4985 8.90571 15.4121 numMergedOcc 0
23 mol 186 unq 3 iso 0 dist 9.00537 9.6283 8.85948 9.40374 6.61112 14.4322 numMergedOcc 0
24 mol 186 unq 4 iso 0 dist 8.9388 8.86574 16.2492 8.63909 8.90571 17.1114 numMergedOcc 0
25 mol 186 unq 5 iso 0 dist 8.9388 8.86574 16.2492 12.4751 6.61112 21.0905 numMergedOcc 0
26 mol 188 unq 0 iso 0 dist 8.01604 9.81333 3.42559 10.0103 7.88013 7.86092 numMergedOcc 0
27 mol 188 unq 1 iso 0 dist 9.07006 9.81333 6.93096 10.0103 9.90062 7.86092 numMergedOcc 0
28 mol 195 unq 0 iso 0 dist 8.08491 9.33055 5.60873 4.98231 7.41662 6.59544 numMergedOcc 0
29 mol 207 unq 0 iso 0 dist 7.25953 9.064 4.67727 5.6688 5.12567 9.29009 numMergedOcc 0
30 mol 207 unq 1 iso 0 dist 9.05688 9.064 10.0842 10.6526 9.98372 14.7287 numMergedOcc 0
31 mol 207 unq 2 iso 0 dist 9.05688 9.064 10.0842 5.6688 6.0563 9.29009 numMergedOcc 0
32 mol 250 unq 0 iso 0 dist 8.51613 6.83662 8.71644 6.15778 6.59244 10.7288 numMergedOcc 0
33 mol 277 unq 0 iso 0 dist 7.88009 8.70774 5.9732 13.3794 9.57499 12.762 numMergedOcc 0
34 mol 277 unq 1 iso 0 dist 7.88009 8.70774 5.9732 5.90394 5.46926 7.42932 numMergedOcc 0
35 mol 277 unq 2 iso 0 dist 7.88009 8.70774 5.9732 9.57081 8.9682 4.9764 numMergedOcc 0
36 mol 277 unq 3 iso 0 dist 5.80061 8.70774 3.79766 5.90394 5.13913 7.42932 numMergedOcc 0
37 mol 277 unq 4 iso 0 dist 5.80061 8.70774 3.79766 9.57081 6.92711 4.9764 numMergedOcc 0
38 mol 292 unq 0 iso 0 dist 7.48212 8.06614 9.42231 5.0721 7.20674 4.49592 numMergedOcc 0
