0 mol 30 unq 0 iso 0 dist 9.50224 8.64725 7.47204 9.67564 9.10395 4.60505 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 7.52742 8.64047 14.8764 6.24296 8.175 12.7386 numMergedOcc 0
2 mol 85 unq 1 iso 0 dist 7.52742 8.64047 14.8764 6.83218 9.3414 14.1999 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 5.27541 8.21739 8.69953 9.43355 8.99253 4.97727 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 5.27541 8.21739 8.69953 5.64141 3.78587 5.77343 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 5.27541 8.21739 8.69953 5.46186 10.5386 11.0802 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 5.27541 4.78377 8.48621 9.43355 8.99253 13.8087 numMergedOcc 0
7 mol 93 unq 4 iso 0 dist 5.27541 4.78377 8.48621 5.64141 3.78587 9.96831 numMergedOcc 0
8 mol 93 unq 5 iso 0 dist 5.27541 4.78377 8.48621 5.46186 10.5386 5.33894 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 6.4081 8.70685 6.85756 5.82551 3.94084 4.21171 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 9.86236 9.70095 13.1465 8.29463 10.4664 12.068 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 9.51356 7.48868 5.61285 7.09239 9.74266 8.76577 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 5.52744 8.78339 5.98491 9.22792 11.7817 16.6117 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 5.52744 8.78339 5.98491 7.85696 8.23538 12.8276 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 5.52744 8.78339 5.98491 5.00402 5.74741 10.9737 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 5.52744 8.78339 5.98491 6.17773 3.88002 7.02093 numMergedOcc 0
16 mol 186 unq 4 iso 0 dist 6.23859 9.18314 10.2999 7.81696 7.48305 11.924 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.64578 5.6619 6.92708 6.58055 6.34948 7.16787 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 7.02833 5.6619 5.1292 6.58055 9.42722 7.16787 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 5.06731 6.69569 9.46764 9.98518 11.2805 13.2109 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 5.06731 6.69569 9.46764 9.98518 11.2805 13.2109 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 5.06731 6.69569 9.46764 9.98518 11.2805 13.2109 numMergedOcc 0
