0 mol 26 unq 0 iso 0 dist 8.06656 4.25444 8.42581 13.0316 6.74848 11.553 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 9.10096 10.1898 5.86571 3.98831 6.99108 6.56778 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 7.63894 8.43244 7.54496 9.64845 7.31784 4.48233 numMergedOcc 0
3 mol 90 unq 1 iso 0 dist 6.17315 12.4268 7.54496 12.0042 7.31784 4.48233 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 7.46327 4.55399 7.85041 10.4036 7.62611 6.957 numMergedOcc 0
5 mol 147 unq 0 iso 0 dist 9.60646 12.0852 5.1101 10.23 7.25644 10.7872 numMergedOcc 0
6 mol 147 unq 1 iso 0 dist 9.60646 14.0758 7.01133 10.23 7.25644 7.66774 numMergedOcc 0
7 mol 151 unq 0 iso 0 dist 8.14552 4.96324 5.63814 7.93506 4.74531 8.3622 numMergedOcc 0
8 mol 151 unq 1 iso 0 dist 6.01918 8.48544 5.63814 4.27432 4.74531 8.3622 numMergedOcc 0
9 mol 163 unq 0 iso 0 dist 9.07256 12.2445 8.21476 4.59718 9.79069 15.4471 numMergedOcc 0
10 mol 163 unq 1 iso 0 dist 9.07256 12.2445 8.21476 13.6675 9.27496 9.33755 numMergedOcc 0
11 mol 163 unq 2 iso 0 dist 9.07256 5.48417 7.66897 4.59718 9.79069 9.54216 numMergedOcc 0
12 mol 163 unq 3 iso 0 dist 9.07256 5.48417 7.66897 13.6675 9.27496 10.7572 numMergedOcc 0
13 mol 182 unq 0 iso 0 dist 6.78113 9.50216 8.89822 9.66017 8.2169 11.9845 numMergedOcc 0
14 mol 182 unq 1 iso 0 dist 6.78113 9.50216 8.89822 5.91922 8.52103 12.8718 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.67802 10.3571 7.94153 10.9082 4.5271 4.35079 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 9.67802 10.3571 7.94153 5.48326 7.02575 5.34643 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 9.18314 10.5919 7.94153 9.9497 4.5271 4.35079 numMergedOcc 0
18 mol 186 unq 3 iso 0 dist 9.18314 10.5919 7.94153 10.094 7.02575 5.34643 numMergedOcc 0
19 mol 213 unq 0 iso 0 dist 6.98756 7.28957 7.37935 6.26806 8.42053 9.84448 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 7.84953 10.2089 6.86795 5.95332 8.3087 5.89482 numMergedOcc 0
21 mol 218 unq 1 iso 0 dist 7.84953 4.40481 6.61099 5.95332 8.3087 6.65167 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 7.10883 4.42378 5.13453 5.32385 8.20162 6.16433 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 9.70241 10.4764 7.25677 7.74918 7.85414 6.56697 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 8.31175 5.06556 8.23056 7.12113 9.30921 6.29016 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 8.64036 10.945 9.96468 10.9909 8.53065 6.18986 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 8.64036 10.945 9.96468 8.39689 8.67489 9.09482 numMergedOcc 0
27 mol 282 unq 2 iso 0 dist 8.64036 12.1895 9.59817 10.9909 8.53065 10.2999 numMergedOcc 0
28 mol 282 unq 3 iso 0 dist 8.64036 12.1895 9.59817 8.39689 8.67489 6.21176 numMergedOcc 0
