0 mol 33 unq 0 iso 0 dist 5.74739 7.59354 7.15141 6.07527 7.14232 11.0298 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 9.532 15.0033 9.99643 5.33982 7.52103 11.5723 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 9.532 15.0033 9.99643 11.6086 8.46556 3.60123 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 8.09807 9.72979 9.9997 12.3322 8.76461 4.98203 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.80802 9.23555 7.80757 7.75819 9.23023 10.928 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.80802 11.0548 9.2835 7.75819 9.23023 7.59211 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 9.80802 8.34252 5.02591 7.75819 9.23023 5.13304 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 5.94669 6.48966 5.09114 7.56329 6.78949 9.14438 numMergedOcc 0
8 mol 122 unq 1 iso 0 dist 5.94669 6.48966 5.09114 5.85988 9.40018 12.0108 numMergedOcc 0
9 mol 196 unq 0 iso 0 dist 9.99721 5.73826 6.60651 5.41712 6.25429 4.73252 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 9.24777 10.1684 6.22696 8.64161 8.3337 6.19883 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 6.40983 12.2642 7.36642 6.67855 5.96555 7.49505 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 7.08106 6.82955 7.19917 8.87587 8.62103 11.8117 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 7.84754 11.2513 5.76077 7.80173 5.89502 5.03278 numMergedOcc 0
14 mol 253 unq 1 iso 0 dist 7.84754 11.2513 5.76077 13.6584 7.15815 4.58695 numMergedOcc 0
15 mol 253 unq 2 iso 0 dist 7.84754 12.6702 7.0247 7.80173 5.89502 12.6079 numMergedOcc 0
16 mol 253 unq 3 iso 0 dist 7.84754 12.6702 7.0247 13.6584 7.15815 11.088 numMergedOcc 0
17 mol 253 unq 4 iso 0 dist 6.71362 9.33433 5.76077 5.08947 5.89502 5.03278 numMergedOcc 0
18 mol 253 unq 5 iso 0 dist 6.71362 9.33433 5.76077 9.85961 7.15815 4.58695 numMergedOcc 0
19 mol 253 unq 6 iso 0 dist 6.71362 11.5994 7.0247 5.08947 5.89502 12.6079 numMergedOcc 0
20 mol 253 unq 7 iso 0 dist 6.71362 11.5994 7.0247 9.85961 7.15815 11.088 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 9.07855 5.10822 9.47382 10.6732 9.54857 12.8939 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 7.27446 9.24472 4.96568 4.50567 9.772 9.37522 numMergedOcc 0
23 mol 271 unq 0 iso 0 dist 5.86247 3.96661 5.98336 4.25291 9.36832 5.17979 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 9.32985 15.2382 7.22438 16.0036 9.96394 7.51377 numMergedOcc 0
25 mol 293 unq 0 iso 0 dist 5.86457 7.82447 8.90008 6.16873 6.27435 12.4441 numMergedOcc 0
