0 mol 18 unq 0 iso 0 dist 6.60128 7.66002 4.75628 8.81762 8.45128 6.6768 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.60128 7.66002 4.75628 5.32149 9.88653 10.1168 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 6.60128 6.83177 12.5276 8.81762 8.45128 12.6736 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 6.60128 6.83177 12.5276 5.32149 9.88653 5.73846 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 7.67558 9.25342 12.3432 9.44151 4.90352 10.7399 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.36315 9.57204 8.00882 6.84521 14.141 13.8309 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 9.36315 9.57204 8.00882 8.90024 16.9053 17.7655 numMergedOcc 0
7 mol 43 unq 2 iso 0 dist 9.36315 9.57204 8.00882 6.78532 11.5022 14.5683 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 8.09741 8.86576 4.77259 9.25901 6.60114 7.74462 numMergedOcc 0
9 mol 90 unq 1 iso 0 dist 8.09741 8.86576 4.77259 7.96299 7.39819 11.6072 numMergedOcc 0
10 mol 90 unq 2 iso 0 dist 8.43532 8.86576 11.5295 9.25901 7.28798 7.74462 numMergedOcc 0
11 mol 90 unq 3 iso 0 dist 8.43532 8.86576 11.5295 7.96299 12.4809 11.6072 numMergedOcc 0
12 mol 94 unq 0 iso 0 dist 6.33571 8.32077 5.70273 6.31237 9.24549 10.4772 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 7.31892 6.42569 6.72224 8.94541 5.08964 9.54131 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 6.59061 9.87506 4.39257 5.21803 4.7924 6.9163 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.69565 7.21359 10.1004 6.0639 4.77798 5.85613 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 9.69565 7.21359 10.1004 6.91355 9.72802 10.0304 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 6.27573 8.2419 10.4961 6.03738 7.41279 5.45786 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 5.21387 7.97228 8.79459 9.07206 6.41758 8.32714 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 7.21215 8.55696 13.1109 6.95233 8.34545 5.928 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 7.21215 8.55696 13.1109 9.61741 16.1108 9.08196 numMergedOcc 0
21 mol 266 unq 2 iso 0 dist 7.21215 8.55696 13.1109 5.61056 9.99445 6.4179 numMergedOcc 0
22 mol 266 unq 3 iso 0 dist 7.21215 7.45814 4.37625 6.95233 8.34545 11.1633 numMergedOcc 0
23 mol 266 unq 4 iso 0 dist 7.21215 7.45814 4.37625 9.61741 16.1108 16.5582 numMergedOcc 0
24 mol 266 unq 5 iso 0 dist 7.21215 7.45814 4.37625 5.61056 9.99445 11.8299 numMergedOcc 0
25 mol 294 unq 0 iso 0 dist 8.79534 9.91042 12.8567 7.77765 16.3624 12.9029 numMergedOcc 0
