0 mol 10 unq 0 iso 0 dist 8.99402 9.78153 17.1926 8.16906 5.05883 14.8787 4.22006 9.75001 12.5238 10.9096 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.99402 9.78153 17.1926 8.16906 5.05883 14.8787 4.87654 9.06457 10.2416 9.89713 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.01454 9.53081 5.41488 5.43913 9.12054 13.4515 12.665 8.94842 7.34325 17.3341 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 6.01454 9.53081 5.41488 5.43913 9.12054 13.4515 14.1985 9.9555 6.42037 18.737 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 6.01454 9.53081 5.41488 8.26877 13.688 17.6258 12.665 8.94842 7.34325 20.6489 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 6.01454 9.53081 5.41488 8.26877 13.688 17.6258 14.1985 9.9555 6.42037 22.4406 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 6.65972 8.14479 4.13187 8.12985 8.0318 7.318 9.18411 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 7.41952 8.64686 9.57704 4.2253 9.07516 9.13196 8.12985 8.0318 7.318 11.446 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 6.6146 9.06641 5.12529 8.63446 3.78122 6.65219 6.55381 8.48639 12.0429 7.62463 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 5.78962 8.91354 7.47242 8.91998 5.4863 10.8497 5.09341 7.77953 9.84288 7.71625 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 6.68364 6.87456 7.87375 8.10681 9.19685 3.9771 5.88056 5.44814 11.1097 11.8292 numMergedOcc 0
11 mol 157 unq 0 iso 0 dist 9.668 6.8976 11.1313 8.36016 7.72329 5.07066 5.332 9.35772 8.9078 7.91458 numMergedOcc 0
12 mol 198 unq 0 iso 0 dist 4.58291 8.51153 3.96154 7.94413 6.52619 7.14873 6.35535 9.12973 12.7107 13.9691 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 7.95917 5.30972 4.68656 4.78349 9.11574 12.7666 11.7634 numMergedOcc 0
14 mol 244 unq 0 iso 0 dist 6.51428 7.43391 4.69664 9.3491 12.2668 9.14405 11.8733 8.42464 11.2389 19.2005 numMergedOcc 0
15 mol 244 unq 1 iso 0 dist 6.51428 7.79787 13.4155 9.3491 12.2668 6.88123 11.8733 8.42464 19.6201 19.2005 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 7.58833 3.67935 4.88298 6.62413 7.19269 4.49386 6.46469 9.1515 8.56493 11.0585 numMergedOcc 0
17 mol 249 unq 1 iso 0 dist 7.58833 8.00386 10.9665 6.62413 7.19269 5.33399 6.46469 9.1515 14.1386 11.0585 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 5.78017 8.03486 7.78018 9.98182 6.3791 5.04826 4.91802 8.9352 8.34313 11.6824 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 8.78203 8.03486 5.38411 9.98182 9.86569 5.04826 4.91802 5.8845 8.34313 11.6824 numMergedOcc 0
