0 mol 6 unq 0 iso 0 dist 8.99368 6.27318 8.70244 5.16581 8.41731 4.53373 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.15677 12.1626 9.7522 14.1383 8.44506 14.6525 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.61029 7.53125 9.7522 9.77186 8.44506 14.6525 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 7.15141 11.0298 7.14232 6.96521 9.63263 8.76485 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 7.16036 11.0716 9.96265 9.32021 7.52117 8.17152 numMergedOcc 0
5 mol 44 unq 1 iso 0 dist 7.16036 7.93542 9.70459 9.32021 7.52117 10.0357 numMergedOcc 0
6 mol 44 unq 2 iso 0 dist 7.16036 4.61354 7.78905 9.32021 7.52117 7.37043 numMergedOcc 0
7 mol 44 unq 3 iso 0 dist 7.16036 6.03595 9.44909 9.32021 7.52117 6.36853 numMergedOcc 0
8 mol 65 unq 0 iso 0 dist 9.9997 4.98203 8.76461 5.23119 9.14931 9.11969 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.28737 5.37389 8.58841 6.38454 4.79949 5.25697 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 8.28737 5.37389 8.58841 11.5407 7.27693 10.7962 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 7.65229 6.50047 7.15985 12.468 8.729 6.84906 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 8.59784 9.25954 5.63005 12.9632 8.56342 9.79485 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 8.59784 9.25954 5.63005 4.31572 6.37542 6.81112 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 8.72463 10.0479 8.30654 4.88215 8.41611 6.29937 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 8.72463 10.0479 8.30654 8.25783 7.63338 6.49958 numMergedOcc 0
16 mol 143 unq 2 iso 0 dist 8.72463 10.0479 8.30654 14.7431 9.03707 6.80782 numMergedOcc 0
17 mol 143 unq 3 iso 0 dist 8.72463 10.0479 8.30654 12.956 7.25673 5.82537 numMergedOcc 0
18 mol 159 unq 0 iso 0 dist 7.78695 6.08143 7.97007 6.47213 7.25742 6.23157 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 4.93984 6.87303 8.14096 6.31396 9.94125 4.90755 numMergedOcc 0
20 mol 167 unq 1 iso 0 dist 4.93984 6.01114 8.43038 6.31396 9.94125 10.8056 numMergedOcc 0
21 mol 167 unq 2 iso 0 dist 4.93984 9.04662 9.87966 6.31396 9.94125 13.8234 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 5.63906 5.88166 8.03995 8.39509 9.83476 9.52773 numMergedOcc 0
23 mol 186 unq 1 iso 0 dist 5.63906 5.88166 8.03995 6.91649 6.258 11.8884 numMergedOcc 0
24 mol 192 unq 0 iso 0 dist 9.05666 11.524 9.90531 6.93447 7.24199 7.32981 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 6.83122 6.06185 9.51764 8.62938 6.38157 10.5029 numMergedOcc 0
26 mol 214 unq 1 iso 0 dist 6.83122 12.1024 5.36829 8.62938 6.38157 8.38755 numMergedOcc 0
27 mol 253 unq 0 iso 0 dist 5.76077 5.03278 5.89502 5.37783 7.77998 5.73565 numMergedOcc 0
28 mol 253 unq 1 iso 0 dist 5.76077 4.58695 7.15815 5.37783 7.77998 9.82329 numMergedOcc 0
29 mol 253 unq 2 iso 0 dist 7.0247 12.6079 5.89502 14.5125 7.77998 5.73565 numMergedOcc 0
30 mol 253 unq 3 iso 0 dist 7.0247 11.088 7.15815 14.5125 7.77998 9.82329 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 9.47382 12.8939 9.54857 15.3317 8.55558 12.7168 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 9.27588 12.8888 8.59986 7.54414 7.71657 5.70666 numMergedOcc 0
33 mol 271 unq 0 iso 0 dist 5.98336 5.17979 9.36832 6.29514 9.63775 4.41662 numMergedOcc 0
