0 mol 61 unq 0 iso 0 dist 5.74014 5.97418 5.30715 9.43734 8.51839 7.93498 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 9.09269 7.30392 16.2245 7.49995 7.49792 12.4451 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.61203 8.20839 4.73219 8.0664 7.31881 9.50458 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 7.71862 9.41965 6.01245 3.80878 8.4902 11.8175 numMergedOcc 0
4 mol 74 unq 1 iso 0 dist 9.73082 9.41965 10.0767 3.80878 8.30395 11.8175 numMergedOcc 0
5 mol 96 unq 0 iso 0 dist 8.94847 5.5851 6.04753 6.61175 7.22615 8.79886 numMergedOcc 0
6 mol 104 unq 0 iso 0 dist 6.12716 8.44593 5.83615 9.01125 9.58427 9.43136 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 9.61215 9.01131 11.4714 8.3346 8.09682 15.5849 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 9.61215 9.01131 11.4714 10.1291 8.35926 11.4598 numMergedOcc 0
9 mol 123 unq 2 iso 0 dist 9.61215 9.01131 11.4714 14.6702 7.41568 18.7864 numMergedOcc 0
10 mol 157 unq 0 iso 0 dist 7.78927 6.66184 6.72897 4.15636 8.97914 8.36016 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 6.72322 8.66056 10.0941 10.7405 6.51748 9.27714 numMergedOcc 0
12 mol 158 unq 1 iso 0 dist 6.72322 8.34722 11.799 10.7405 6.51748 16.547 numMergedOcc 0
13 mol 283 unq 0 iso 0 dist 9.24924 6.89455 9.94666 8.2722 7.17276 11.8037 numMergedOcc 0
14 mol 283 unq 1 iso 0 dist 9.24924 8.821 10.1755 8.2722 7.17276 14.1679 numMergedOcc 0
15 mol 283 unq 2 iso 0 dist 9.24924 9.82337 12.098 8.2722 7.17276 9.9743 numMergedOcc 0
16 mol 283 unq 3 iso 0 dist 9.72248 8.07626 9.94666 5.93642 7.17276 11.8037 numMergedOcc 0
17 mol 283 unq 4 iso 0 dist 9.72248 6.3448 12.098 5.93642 7.17276 9.9743 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 7.41633 5.62295 12.6047 3.39008 5.2862 8.2236 numMergedOcc 0
19 mol 284 unq 1 iso 0 dist 5.52837 5.62295 10.936 3.39008 5.31097 8.2236 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 6.81636 4.66252 4.76371 6.1158 8.4625 9.52694 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 6.81636 4.66252 4.76371 6.1158 8.4625 9.52694 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 6.81636 4.66252 4.76371 6.1158 8.4625 9.52694 numMergedOcc 0
