0 mol 9 unq 0 iso 0 dist 7.70405 7.58007 5.10609 7.90063 8.01055 11.0194 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.70405 7.58007 5.10609 4.86477 8.61976 9.60177 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 5.27589 8.06022 11.3369 10.0167 8.07914 17.9283 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.34433 9.57204 15.8406 5.9674 7.32913 12.4528 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 7.65981 9.47099 13.238 8.24859 8.11345 16.866 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 8.8599 8.58684 11.9331 11.4822 6.3141 17.1575 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 7.70037 9.2309 7.48749 5.65257 8.70964 13.5863 numMergedOcc 0
7 mol 87 unq 0 iso 0 dist 8.21588 6.90483 5.6513 5.34066 5.62336 8.29967 numMergedOcc 0
8 mol 87 unq 1 iso 0 dist 8.21588 7.67411 6.69874 5.34066 5.62336 8.5776 numMergedOcc 0
9 mol 87 unq 2 iso 0 dist 6.62798 6.90483 7.41574 10.7803 9.90256 16.1361 numMergedOcc 0
10 mol 87 unq 3 iso 0 dist 6.62798 6.90483 7.41574 5.34066 5.63748 8.29967 numMergedOcc 0
11 mol 87 unq 4 iso 0 dist 6.62798 7.67411 3.66319 10.7803 9.90256 12.3694 numMergedOcc 0
12 mol 87 unq 5 iso 0 dist 6.62798 7.67411 3.66319 5.34066 5.63748 8.5776 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 7.40582 6.17537 5.88809 15.2733 8.15664 12.0355 numMergedOcc 0
14 mol 94 unq 0 iso 0 dist 6.63924 8.32077 5.24903 4.48902 9.25496 8.2128 numMergedOcc 0
15 mol 102 unq 0 iso 0 dist 7.90927 8.63253 6.43211 11.8843 8.03869 13.5823 numMergedOcc 0
16 mol 102 unq 1 iso 0 dist 7.90927 5.15752 6.93587 11.8843 8.03869 13.3886 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.35708 9.76509 9.79728 12.3139 9.2254 12.9319 numMergedOcc 0
18 mol 245 unq 0 iso 0 dist 8.03294 9.77742 14.1895 8.2332 9.96585 16.0473 numMergedOcc 0
19 mol 245 unq 1 iso 0 dist 8.03294 9.77742 14.1895 9.39435 7.27022 18.0528 numMergedOcc 0
20 mol 245 unq 2 iso 0 dist 8.03294 9.77742 14.1895 15.5115 7.95061 21.9676 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 9.4344 8.3749 12.4893 7.49568 8.19645 15.025 numMergedOcc 0
22 mol 257 unq 0 iso 0 dist 9.94785 8.71571 8.93071 5.25261 8.09912 11.283 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 8.36611 7.85381 6.13416 8.31476 8.88741 8.69675 numMergedOcc 0
24 mol 273 unq 0 iso 0 dist 7.29081 8.24507 4.62586 12.2394 5.78262 9.57582 numMergedOcc 0
25 mol 273 unq 1 iso 0 dist 7.29081 8.24507 4.62586 7.5139 7.6489 11.4985 numMergedOcc 0
26 mol 293 unq 0 iso 0 dist 9.92737 9.64743 6.51518 7.23495 9.65156 11.8618 numMergedOcc 0
