0 mol 7 unq 0 iso 0 dist 8.57437 5.77374 5.63739 17.7278 9.85726 13.148 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 5.01162 9.83754 9.7298 9.88291 6.59893 12.134 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 5.01162 9.83754 9.7298 4.07894 9.06005 11.2811 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 7.28917 7.02173 4.18809 16.7918 9.62468 12.364 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 5.58346 9.10386 5.47475 4.69583 6.89722 7.26679 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 9.10386 5.58346 5.47475 15.7901 9.68526 11.7436 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 9.10386 5.58346 5.47475 4.69583 7.26679 6.89722 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 9.10386 5.58346 5.47475 15.8603 9.30776 14.4206 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 9.78545 5.68726 6.18163 14.2026 9.58544 12.6321 numMergedOcc 0
9 mol 73 unq 5 iso 0 dist 9.97998 7.46882 6.18163 9.27925 9.58544 12.6321 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 5.74364 8.60026 10.1168 4.52119 4.98104 10.7379 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 6.97361 8.52125 10.2399 5.89399 7.88564 6.78459 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 8.52125 6.97361 10.2399 5.89399 6.78459 7.88564 numMergedOcc 0
13 mol 102 unq 0 iso 0 dist 8.07962 9.54857 7.56811 8.58092 9.01767 9.80678 numMergedOcc 0
14 mol 102 unq 1 iso 0 dist 9.54857 8.07962 7.56811 7.54459 9.43411 12.9236 numMergedOcc 0
15 mol 102 unq 2 iso 0 dist 9.54857 8.07962 7.56811 8.58092 9.80678 9.01767 numMergedOcc 0
16 mol 102 unq 3 iso 0 dist 7.58908 9.32058 7.56811 12.5781 9.01767 9.80678 numMergedOcc 0
17 mol 102 unq 4 iso 0 dist 9.32058 7.58908 7.56811 11.0171 9.43411 12.9236 numMergedOcc 0
18 mol 102 unq 5 iso 0 dist 9.32058 7.58908 7.56811 12.5781 9.80678 9.01767 numMergedOcc 0
19 mol 108 unq 0 iso 0 dist 5.52402 7.57593 6.45014 4.93762 7.29462 5.4057 numMergedOcc 0
20 mol 108 unq 1 iso 0 dist 7.57593 5.52402 6.45014 4.93762 5.4057 7.29462 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 6.67306 9.2167 7.15643 8.8283 9.42766 11.7808 numMergedOcc 0
22 mol 147 unq 0 iso 0 dist 6.00651 8.52428 9.36152 10.4619 9.84695 15.9157 numMergedOcc 0
23 mol 147 unq 1 iso 0 dist 6.00651 8.52428 9.36152 6.91778 9.18866 12.9055 numMergedOcc 0
24 mol 155 unq 0 iso 0 dist 6.53806 8.47335 5.33649 9.88413 7.02715 12.2162 numMergedOcc 0
25 mol 183 unq 0 iso 0 dist 9.92635 5.83335 14.4206 10.0008 7.31181 15.6552 numMergedOcc 0
26 mol 183 unq 1 iso 0 dist 7.85507 9.86506 15.9375 9.95614 7.31181 19.7973 numMergedOcc 0
27 mol 183 unq 2 iso 0 dist 7.85507 7.86724 14.4206 9.95614 7.31181 15.6552 numMergedOcc 0
28 mol 188 unq 0 iso 0 dist 8.48582 9.94804 8.07108 4.04545 9.24118 12.7721 numMergedOcc 0
29 mol 197 unq 0 iso 0 dist 5.79753 8.47576 5.42954 13.0113 8.64255 13.0043 numMergedOcc 0
30 mol 197 unq 1 iso 0 dist 7.56537 9.89975 7.28269 4.57437 8.64255 10.499 numMergedOcc 0
31 mol 205 unq 0 iso 0 dist 9.32657 6.21409 6.26321 10.7813 7.07183 11.098 numMergedOcc 0
32 mol 219 unq 0 iso 0 dist 8.62654 9.52151 16.4807 9.31035 9.77442 15.1687 numMergedOcc 0
33 mol 238 unq 0 iso 0 dist 9.91921 8.20243 4.85921 4.7157 9.31417 5.56719 numMergedOcc 0
34 mol 238 unq 1 iso 0 dist 8.20243 9.91921 4.85921 4.7157 5.56719 9.31417 numMergedOcc 0
35 mol 259 unq 0 iso 0 dist 5.22111 7.97113 4.70261 5.41945 7.93997 12.2198 numMergedOcc 0
36 mol 259 unq 1 iso 0 dist 8.53598 8.38479 4.70261 10.2837 7.93997 12.2198 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 7.62562 8.15217 6.07831 6.96875 7.79904 12.3343 numMergedOcc 0
38 mol 274 unq 1 iso 0 dist 7.62562 8.15217 6.07831 15.8929 9.02749 13.3926 numMergedOcc 0
39 mol 274 unq 2 iso 0 dist 8.26851 8.14634 5.09461 4.56913 6.00877 8.66451 numMergedOcc 0
40 mol 274 unq 3 iso 0 dist 8.14634 8.26851 5.09461 4.56913 8.66451 6.00877 numMergedOcc 0
