0 mol 26 unq 0 iso 0 dist 9.44899 9.79074 18.5662 7.78176 5.272 17.415 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 8.87499 8.2359 10.4823 13.1527 8.51968 14.4517 numMergedOcc 0
2 mol 74 unq 0 iso 0 dist 9.46313 9.02317 5.14252 11.7093 8.18048 12.8008 numMergedOcc 0
3 mol 74 unq 1 iso 0 dist 9.46313 7.81632 6.28556 11.7093 8.18048 13.1034 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 8.90372 6.09124 10.6185 5.18488 6.22956 10.2374 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 8.90372 6.09124 10.6185 3.86636 9.51587 9.04246 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 6.09124 8.90372 10.6185 3.86636 9.04246 9.51587 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 8.81788 7.01323 4.14485 9.86312 9.18431 11.3519 numMergedOcc 0
8 mol 91 unq 1 iso 0 dist 7.01323 8.81788 4.14485 10.199 9.77304 13.8761 numMergedOcc 0
9 mol 91 unq 2 iso 0 dist 6.26129 7.23655 4.12972 10.7001 9.18431 13.2769 numMergedOcc 0
10 mol 91 unq 3 iso 0 dist 6.26129 5.8881 4.14485 10.7001 9.18431 11.3519 numMergedOcc 0
11 mol 91 unq 4 iso 0 dist 5.8881 7.23655 4.59251 13.2946 9.77304 13.0289 numMergedOcc 0
12 mol 91 unq 5 iso 0 dist 5.8881 6.26129 4.14485 13.2946 9.77304 13.8761 numMergedOcc 0
13 mol 110 unq 0 iso 0 dist 7.36326 7.34054 7.8037 11.5698 7.67702 9.75478 numMergedOcc 0
14 mol 188 unq 0 iso 0 dist 6.86607 8.62211 7.00809 5.70764 5.4981 11.3451 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 9.92576 4.80928 12.5546 9.03017 9.744 13.1106 numMergedOcc 0
16 mol 241 unq 1 iso 0 dist 9.92576 4.80928 12.5546 6.85042 7.62827 8.88751 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 5.87353 7.87214 6.22759 5.7123 8.49619 12.8681 numMergedOcc 0
18 mol 265 unq 0 iso 0 dist 8.35562 5.67503 7.24033 9.6551 5.14122 10.201 numMergedOcc 0
19 mol 271 unq 0 iso 0 dist 6.09342 8.91093 4.36568 6.92037 8.98817 10.0921 numMergedOcc 0
