0 mol 81 unq 0 iso 0 dist 9.61504 17.4206 9.62234 9.52356 8.36954 11.921 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 6.2753 6.38992 9.01812 6.76125 7.67463 6.62562 numMergedOcc 0
2 mol 123 unq 0 iso 0 dist 8.0933 7.35357 8.111 12.1655 8.24171 15.1597 numMergedOcc 0
3 mol 123 unq 1 iso 0 dist 8.0933 7.35357 8.111 7.01429 5.38148 9.43434 numMergedOcc 0
4 mol 123 unq 2 iso 0 dist 8.0933 7.35357 8.111 7.40378 6.63094 9.21204 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 9.66083 12.0443 8.57739 13.4697 9.0745 10.872 numMergedOcc 0
6 mol 194 unq 0 iso 0 dist 7.31316 14.1448 9.38984 16.0694 8.93352 11.9992 numMergedOcc 0
7 mol 194 unq 1 iso 0 dist 7.31316 12.1716 9.91118 16.0694 8.93352 15.2884 numMergedOcc 0
8 mol 194 unq 2 iso 0 dist 8.9865 8.50813 9.38984 6.34292 8.93352 11.9992 numMergedOcc 0
9 mol 194 unq 3 iso 0 dist 8.9865 12.6254 9.91118 6.34292 8.93352 15.2884 numMergedOcc 0
10 mol 231 unq 0 iso 0 dist 6.8533 10.613 7.3268 4.18904 5.45266 6.58152 numMergedOcc 0
11 mol 231 unq 1 iso 0 dist 6.8533 10.613 7.3268 8.31171 9.02803 9.72658 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 7.38867 12.4004 8.55044 13.2785 8.63893 5.8401 numMergedOcc 0
13 mol 257 unq 0 iso 0 dist 8.81508 6.64096 9.6834 4.52088 8.86142 8.14464 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 5.57978 9.65708 6.76495 6.14222 7.59138 7.84502 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 5.57978 10.4505 5.4557 6.14222 7.59138 9.31785 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 8.90108 7.64772 8.12739 11.4732 8.87546 12.292 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.29668 8.598 5.30118 10.577 9.97939 7.57364 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 7.29668 10.9452 8.98698 10.577 9.97939 3.99731 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.29668 8.598 5.30118 10.577 9.97939 7.57364 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.29668 10.9452 8.98698 10.577 9.97939 3.99731 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.29668 8.598 5.30118 10.577 9.97939 7.57364 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 7.29668 10.9452 8.98698 10.577 9.97939 3.99731 numMergedOcc 0
