0 mol 48 unq 0 iso 0 dist 7.38928 9.40644 8.74683 7.99434 9.85208 3.85292 11.0398 14.4137 7.66163 7.11491 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 7.38928 5.35252 5.03338 7.99434 9.85208 6.44604 11.0398 14.4137 9.48288 7.11491 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 8.36915 9.53081 13.2937 5.43913 5.44336 13.4515 10.7098 13.0397 8.82709 14.4644 numMergedOcc 0
3 mol 48 unq 3 iso 0 dist 8.36915 9.53081 13.2937 8.26877 10.4965 17.6258 10.7098 13.0397 8.82709 17.9225 numMergedOcc 0
4 mol 48 unq 4 iso 0 dist 6.01454 9.53081 5.41488 5.43913 9.12054 13.4515 10.7098 6.99001 8.82709 14.4644 numMergedOcc 0
5 mol 48 unq 5 iso 0 dist 6.01454 9.53081 5.41488 8.26877 13.688 17.6258 10.7098 6.99001 8.82709 17.9225 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 6.65972 8.14479 4.13187 8.69896 13.0659 5.33546 6.86517 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 7.41952 8.64686 9.57704 4.2253 9.07516 9.13196 8.69896 13.0659 5.33546 9.21098 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 5.78962 8.91354 7.47242 8.91998 5.4863 10.8497 12.671 12.6261 7.12701 13.4457 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 7.07421 7.6453 5.06265 4.4077 6.14663 6.61102 8.73165 9.70268 9.7113 12.0376 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 7.07421 7.6453 5.06265 8.4874 5.32811 9.0678 8.73165 9.70268 9.7113 14.1272 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 9.12589 9.6014 9.57585 14.2953 9.91805 8.91143 17.1021 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 7.00683 9.52029 8.61406 9.41594 4.96901 9.47121 16.9386 15.0746 7.59757 14.309 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 7.00683 9.52029 8.61406 9.92651 3.72258 11.8097 16.9386 15.0746 7.59757 17.4033 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 7.95917 5.30972 4.68656 7.26107 8.87054 9.24401 11.4954 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 6.00654 8.86185 8.20191 7.24545 6.94281 13.8399 5.86546 5.4347 8.87182 10.0413 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 6.00654 8.86185 8.20191 7.24545 6.94281 13.8399 8.35939 11.1516 5.95622 14.2572 numMergedOcc 0
17 mol 249 unq 0 iso 0 dist 7.58833 8.00386 10.9665 6.62413 7.19269 5.33399 11.2425 15.2001 9.58168 8.76518 numMergedOcc 0
18 mol 249 unq 1 iso 0 dist 9.04715 8.00386 5.52082 6.62413 4.77145 5.33399 11.2425 12.8292 9.58168 8.76518 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.77392 9.0836 16.492 6.48382 16.2409 7.63149 8.25534 10.3937 9.34312 11.7606 numMergedOcc 0
