0 mol 26 unq 0 iso 0 dist 5.58467 9.15677 7.42841 6.02007 5.92521 12.0119 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 5.58467 9.15677 7.42841 5.41471 7.97592 14.0008 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 4.52881 7.16036 6.07691 3.93424 7.49423 11.0342 numMergedOcc 0
3 mol 110 unq 0 iso 0 dist 9.35378 6.59361 8.6616 3.32173 9.45247 9.10911 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 6.30762 9.64856 5.29246 4.51272 6.94015 11.6508 numMergedOcc 0
5 mol 131 unq 1 iso 0 dist 6.30762 6.38977 8.25445 4.51272 6.94015 10.5762 numMergedOcc 0
6 mol 131 unq 2 iso 0 dist 6.30762 9.69757 11.8349 4.51272 6.94015 14.1103 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 6.81055 9.7168 12.052 6.53248 7.53552 15.0329 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 6.81055 7.38138 5.2593 6.53248 7.53552 11.4505 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 6.77966 9.61132 11.9651 6.52303 7.49948 14.9106 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 6.77966 7.34423 5.1918 6.52303 7.49948 11.3898 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 8.46837 7.39961 9.97803 14.4857 9.15935 13.0835 numMergedOcc 0
12 mol 156 unq 1 iso 0 dist 8.46837 7.80643 5.0966 14.4857 9.15935 10.717 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.11273 8.08787 7.9704 8.57203 6.92364 12.6397 numMergedOcc 0
14 mol 231 unq 0 iso 0 dist 9.35875 9.84965 9.0084 6.84363 8.27156 9.9868 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 8.9569 7.26647 15.1428 5.84274 8.60391 11.0778 numMergedOcc 0
16 mol 261 unq 1 iso 0 dist 8.9569 7.7309 15.7709 5.84274 8.60391 13.0193 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 9.09556 5.81421 5.56416 13.9374 6.80043 9.78483 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 8.37963 7.70229 14.9812 5.85798 7.93643 11.3741 numMergedOcc 0
19 mol 282 unq 1 iso 0 dist 8.37963 7.90792 15.4482 5.85798 7.93643 13.1568 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 4.70976 9.27402 5.21448 6.08355 9.50506 12.31 numMergedOcc 0
21 mol 284 unq 1 iso 0 dist 4.70976 9.26573 5.10189 6.08355 9.50506 13.3754 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 9.83824 9.6958 5.94839 9.33611 8.30521 13.0323 numMergedOcc 0
