0 mol 19 unq 0 iso 0 dist 8.78293 6.50337 4.73101 8.7083 10.1716 5.53102 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.23643 6.50337 12.9293 8.7083 16.2389 5.53102 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 7.82528 6.50337 13.3749 8.7083 14.7321 5.53102 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 6.77912 4.69674 9.58779 4.03844 6.53824 7.52245 numMergedOcc 0
4 mol 107 unq 0 iso 0 dist 8.40312 7.02709 4.91158 10.1994 11.1727 6.71858 numMergedOcc 0
5 mol 107 unq 1 iso 0 dist 8.40312 7.02709 4.91158 12.9752 10.9755 9.37159 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 6.81812 5.82487 3.85992 8.1057 9.56904 6.41507 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 6.81812 5.82487 3.85992 8.01602 9.85902 6.03035 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.38288 8.20715 10.6301 6.20019 12.4009 4.22806 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 6.19042 8.20715 4.15435 6.20019 6.13374 4.22806 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 7.44174 8.20715 9.54775 6.20019 9.08536 4.22806 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 9.80862 6.16081 6.69435 4.39676 9.56225 4.22806 numMergedOcc 0
12 mol 119 unq 4 iso 0 dist 8.43904 6.16081 4.15435 4.39676 6.13374 4.22806 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 8.59981 8.82676 16.7971 9.95656 18.2539 6.81354 numMergedOcc 0
14 mol 127 unq 1 iso 0 dist 7.34519 8.82676 6.16606 9.95656 11.486 6.81354 numMergedOcc 0
15 mol 127 unq 2 iso 0 dist 6.63981 8.17522 6.16606 8.95351 11.486 6.81354 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 4.87541 7.68645 9.7667 11.3569 13.8021 6.44817 numMergedOcc 0
17 mol 219 unq 1 iso 0 dist 4.87541 7.68645 9.7667 9.13819 12.7407 9.36547 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 7.04472 9.29241 6.53691 14.0303 14.3859 9.62446 numMergedOcc 0
19 mol 287 unq 1 iso 0 dist 7.04472 9.29241 6.53691 18.685 15.8234 9.99681 numMergedOcc 0
20 mol 287 unq 2 iso 0 dist 6.4778 9.29241 15.3214 14.0303 20.2037 9.62446 numMergedOcc 0
21 mol 287 unq 3 iso 0 dist 6.4778 9.29241 15.3214 18.685 24.6735 9.99681 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 7.04472 9.29241 6.53691 14.0303 14.3859 9.62446 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 7.04472 9.29241 6.53691 18.685 15.8234 9.99681 numMergedOcc 0
24 mol 288 unq 2 iso 0 dist 6.4778 9.29241 15.3214 14.0303 20.2037 9.62446 numMergedOcc 0
25 mol 288 unq 3 iso 0 dist 6.4778 9.29241 15.3214 18.685 24.6735 9.99681 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 7.04472 9.29241 6.53691 14.0303 14.3859 9.62446 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 7.04472 9.29241 6.53691 18.685 15.8234 9.99681 numMergedOcc 0
28 mol 289 unq 2 iso 0 dist 6.4778 9.29241 15.3214 14.0303 20.2037 9.62446 numMergedOcc 0
29 mol 289 unq 3 iso 0 dist 6.4778 9.29241 15.3214 18.685 24.6735 9.99681 numMergedOcc 0
