0 mol 0 unq 0 iso 0 dist 9.42137 11.6896 9.6994 5.66453 6.26831 6.34883 7.31837 5.24778 11.2072 6.64713 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.42137 14.5258 7.15528 5.66453 6.26831 9.19662 7.31837 5.24778 11.2263 6.64713 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 7.46102 8.25051 8.96553 12.3138 7.3915 7.43529 20.0755 14.1378 14.9611 8.77457 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.7522 15.0931 8.34347 14.6525 8.44506 13.2876 9.44507 10.9837 18.1487 9.5053 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 7.20538 6.93876 8.66265 9.91757 6.77886 6.03623 15.6645 10.0962 11.8747 6.99108 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 11.4574 8.73253 8.26458 9.54477 6.56633 9.24757 6.48232 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.9747 4.75138 5.08437 8.89866 7.26086 7.32662 10.9995 7.06961 6.7117 8.43352 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 5.9747 10.4417 6.48948 8.89866 7.26086 13.4985 10.9995 7.06961 9.42961 8.43352 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 5.9747 11.3628 6.10456 8.89866 7.26086 6.934 10.9995 7.06961 4.47349 8.43352 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 4.50572 6.88489 5.08437 7.87523 7.26086 7.32662 11.1541 7.06961 6.7117 8.43352 numMergedOcc 0
10 mol 98 unq 4 iso 0 dist 4.50572 9.63267 6.48948 7.87523 7.26086 13.4985 11.1541 7.06961 9.42961 8.43352 numMergedOcc 0
11 mol 98 unq 5 iso 0 dist 4.50572 9.82583 6.10456 7.87523 7.26086 6.934 11.1541 7.06961 4.47349 8.43352 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 7.15985 6.68714 9.60462 6.84906 8.729 11.0629 5.42828 5.39346 10.1861 9.77017 numMergedOcc 0
13 mol 112 unq 1 iso 0 dist 7.15985 6.71889 7.45389 6.84906 8.729 5.48848 5.42828 5.39346 10.15 9.77017 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 4.98864 6.59772 6.11741 5.01124 5.74857 6.08806 6.66022 5.22052 11.0224 8.85881 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 4.98864 10.9437 7.88312 5.01124 5.74857 7.21418 6.66022 5.22052 12.13 8.85881 numMergedOcc 0
16 mol 115 unq 2 iso 0 dist 7.95871 4.86477 6.11741 7.39793 5.74857 6.08806 11.2341 5.22052 11.0224 8.85881 numMergedOcc 0
17 mol 115 unq 3 iso 0 dist 7.95871 12.0354 7.88312 7.39793 5.74857 7.21418 11.2341 5.22052 12.13 8.85881 numMergedOcc 0
18 mol 120 unq 0 iso 0 dist 7.04864 4.5543 8.75408 4.63594 8.93905 7.27181 8.73484 8.2619 11.9051 6.03352 numMergedOcc 0
19 mol 120 unq 1 iso 0 dist 7.04864 6.81949 6.44653 4.63594 8.93905 10.5192 8.73484 8.2619 13.082 6.03352 numMergedOcc 0
20 mol 126 unq 0 iso 0 dist 8.32241 4.84035 6.06638 5.93497 9.46588 5.5703 8.97111 6.0268 6.30546 5.94233 numMergedOcc 0
21 mol 126 unq 1 iso 0 dist 8.32241 4.84035 6.06638 5.93497 9.46588 5.5703 9.44367 8.01268 10.0699 8.56219 numMergedOcc 0
22 mol 131 unq 0 iso 0 dist 7.81337 11.4498 6.85062 6.99491 9.29384 9.32969 12.2564 13.1439 11.8327 5.44303 numMergedOcc 0
23 mol 131 unq 1 iso 0 dist 7.81337 11.4498 6.85062 6.99491 9.29384 9.32969 15.1282 13.7237 9.90168 8.50562 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 8.2282 8.20836 9.4027 12.1527 4.57832 6.23142 9.30061 numMergedOcc 0
25 mol 134 unq 1 iso 0 dist 9.92932 6.20443 9.86662 8.2282 8.20836 5.12325 12.1527 4.57832 9.94764 9.30061 numMergedOcc 0
26 mol 134 unq 2 iso 0 dist 9.55556 11.9294 8.94367 4.02705 8.20836 9.4027 11.9876 4.57832 6.23142 9.30061 numMergedOcc 0
27 mol 134 unq 3 iso 0 dist 9.55556 6.36794 9.86662 4.02705 8.20836 5.12325 11.9876 4.57832 9.94764 9.30061 numMergedOcc 0
28 mol 253 unq 0 iso 0 dist 5.89502 9.25001 9.02271 5.73565 7.77998 13.6942 9.9605 5.78064 13.07 8.15091 numMergedOcc 0
29 mol 253 unq 1 iso 0 dist 7.15815 4.93871 9.02271 9.82329 7.77998 13.6942 9.69704 5.78064 13.07 8.15091 numMergedOcc 0
30 mol 261 unq 0 iso 0 dist 8.65236 4.49913 9.14619 3.67304 5.26434 6.04016 11.264 7.39176 10.7876 8.61563 numMergedOcc 0
31 mol 261 unq 1 iso 0 dist 9.73983 4.49913 8.45658 3.67304 8.60026 6.04016 11.264 12.8544 10.7876 8.61563 numMergedOcc 0
