0 mol 7 unq 0 iso 0 dist 9.8603 13.8384 5.72491 15.8072 8.72114 10.1959 15.262 11.8172 14.9635 6.02702 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 10.3237 7.88043 4.60206 5.99972 7.25346 7.81271 5.13353 12.8015 9.68006 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.51421 13 8.80762 4.60206 5.99972 10.0658 7.81271 5.13353 12.5387 9.68006 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 7.46102 12.3138 7.3915 10.4489 8.53529 5.65816 16.9088 12.4076 6.82379 7.03958 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 7.46102 12.3138 7.3915 10.4489 8.53529 5.65816 9.91301 8.4069 10.6335 7.18019 numMergedOcc 0
5 mol 8 unq 2 iso 0 dist 7.46102 12.3138 7.3915 10.4489 8.53529 5.65816 15.6504 12.9016 11.7258 8.44009 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 8.46229 7.36079 7.05346 9.93406 7.32257 8.88528 13.5235 6.14147 10.5699 6.55811 numMergedOcc 0
7 mol 9 unq 1 iso 0 dist 8.46229 7.36079 7.05346 9.93406 7.32257 8.88528 17.0546 10.5747 12.6235 8.64915 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 6.11056 5.36722 6.72502 11.095 8.60554 6.99746 14.2881 14.6259 11.2485 8.4051 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 6.11056 5.36722 6.72502 11.095 8.60554 6.99746 14.4535 10.0952 10.7114 7.29868 numMergedOcc 0
10 mol 24 unq 2 iso 0 dist 6.11056 5.36722 6.72502 6.66757 9.44691 7.05541 14.2881 14.6259 11.2485 8.75662 numMergedOcc 0
11 mol 25 unq 0 iso 0 dist 8.40051 13.0772 6.90155 4.32173 6.16347 11.0508 8.6396 10.9391 17.3821 7.45383 numMergedOcc 0
12 mol 25 unq 1 iso 0 dist 8.40051 13.0772 6.90155 15.9662 7.92503 6.61233 17.3995 10.6808 5.81959 8.6653 numMergedOcc 0
13 mol 25 unq 2 iso 0 dist 8.6396 13.3963 6.6492 4.32173 7.45383 11.7817 8.40051 10.9391 16.357 6.16347 numMergedOcc 0
14 mol 65 unq 0 iso 0 dist 8.76461 9.11969 9.14931 6.59475 6.72639 9.35965 11.2698 5.48814 13.4288 6.76508 numMergedOcc 0
15 mol 65 unq 1 iso 0 dist 8.76461 9.11969 9.14931 11.8419 9.34791 10.7772 18.0462 14.4691 18.5415 7.90294 numMergedOcc 0
16 mol 65 unq 2 iso 0 dist 8.76461 9.11969 9.14931 11.8419 9.34791 10.7772 11.2698 5.48814 13.4288 8.22785 numMergedOcc 0
17 mol 85 unq 0 iso 0 dist 6.58793 4.81974 7.33422 3.88757 7.54568 6.85215 11.7434 10.1164 14.9249 9.39864 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.44385 9.79485 7.99857 4.01593 9.11344 6.96805 5.63005 4.85907 8.56342 6.52773 numMergedOcc 0
19 mol 119 unq 1 iso 0 dist 5.63005 9.79485 8.56342 4.01593 6.52773 6.96805 8.44385 4.85907 7.99857 9.11344 numMergedOcc 0
20 mol 119 unq 2 iso 0 dist 5.63005 6.81112 6.37542 4.01593 6.52773 4.86811 8.44385 4.85907 10.4631 9.11344 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 7.63036 6.90444 6.60567 7.14066 7.36683 6.0634 14.0513 10.7531 7.62942 9.26504 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.59174 5.79227 9.1925 5.32742 9.63959 4.22544 14.8786 12.4198 11.3842 9.96262 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 9.59174 5.79227 9.1925 5.32742 9.63959 4.22544 9.98141 12.321 11.3331 7.21311 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 9.54857 12.7168 8.55558 8.74892 7.08526 6.31909 14.0139 6.96053 10.5803 7.98231 numMergedOcc 0
