0 mol 13 unq 0 iso 0 dist 9.87332 4.37889 7.53416 11.486 12.9956 7.98679 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 5.53102 3.86173 6.41656 7.42956 4.73459 7.46208 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.21811 11.3314 5.80953 15.1755 9.57743 4.90592 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.21811 11.3314 5.80953 5.47982 4.47891 9.36461 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.70016 7.63657 9.586 4.87192 5.11135 8.16324 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 5.13078 3.4435 5.80953 4.87192 9.57743 4.90592 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 5.13078 3.4435 5.80953 9.16583 4.47891 9.36461 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 6.15382 14.8922 9.586 11.0982 5.11135 8.16324 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 6.63216 10.7324 9.586 10.9892 5.11135 8.16324 numMergedOcc 0
9 mol 26 unq 0 iso 0 dist 8.13863 5.60677 6.81793 10.7672 9.45442 6.74848 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 6.33905 13.6446 7.98985 14.4624 8.69385 8.91427 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 8.95637 4.10173 6.14542 9.22853 7.8972 6.48232 numMergedOcc 0
12 mol 135 unq 0 iso 0 dist 5.72277 11.7342 7.28318 15.9685 11.321 9.40325 numMergedOcc 0
13 mol 135 unq 1 iso 0 dist 5.72277 11.7342 7.28318 14.2471 9.28378 8.25527 numMergedOcc 0
14 mol 135 unq 2 iso 0 dist 5.72277 11.7342 7.28318 14.2921 11.9049 8.83856 numMergedOcc 0
15 mol 135 unq 3 iso 0 dist 5.72277 10.0632 7.17599 15.9685 11.321 7.62606 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.61582 4.04186 9.45907 10.7194 9.40383 7.46987 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.16901 3.7016 7.7086 9.33639 11.6976 8.20162 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 6.23614 6.88681 9.82043 9.18343 6.05548 9.23935 numMergedOcc 0
19 mol 225 unq 2 iso 0 dist 6.23614 4.55231 8.22922 9.18343 6.05548 7.77552 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 9.03266 9.96528 8.09509 8.62955 4.34126 7.39391 numMergedOcc 0
