0 mol 5 unq 0 iso 0 dist 7.92988 8.62847 4.42081 7.24092 5.2392 9.22027 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 8.61226 9.03928 5.34619 5.38977 5.14358 8.23784 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 6.79739 8.93805 4.61651 4.87092 5.14358 7.27243 numMergedOcc 0
3 mol 30 unq 2 iso 0 dist 5.90481 9.83449 4.61651 5.85756 5.14358 7.27243 numMergedOcc 0
4 mol 30 unq 3 iso 0 dist 6.30807 9.83449 12.0998 5.85756 9.83737 7.27243 numMergedOcc 0
5 mol 53 unq 0 iso 0 dist 7.08383 6.6473 6.5368 7.13301 9.18436 5.40489 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.04935 8.52697 10.0025 3.89377 9.55191 8.64934 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 8.84466 5.46186 12.9872 6.81453 9.5454 7.23305 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 9.2948 5.46186 5.17052 6.81453 12.2151 7.23305 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 6.79564 6.6142 3.86836 3.98194 4.49975 5.42044 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 8.21127 9.21978 12.6105 3.85674 9.5681 7.65564 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 7.99121 9.26505 12.8905 3.82475 9.47795 7.65564 numMergedOcc 0
12 mol 115 unq 2 iso 0 dist 6.30982 9.26505 11.7277 3.82475 9.29473 7.65564 numMergedOcc 0
13 mol 115 unq 3 iso 0 dist 6.12404 9.26505 8.29196 3.82475 8.42219 7.65564 numMergedOcc 0
14 mol 146 unq 0 iso 0 dist 5.3184 6.76896 10.5314 3.75935 6.93154 7.78784 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 7.45384 9.22792 14.8878 5.44287 12.0181 5.67168 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 7.45384 7.85696 12.1704 5.44287 12.0181 7.74579 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 7.45384 5.00402 10.8153 5.7782 11.9672 8.36129 numMergedOcc 0
18 mol 186 unq 3 iso 0 dist 7.45384 5.00402 10.8153 5.44287 12.0181 5.86483 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 7.24533 9.79864 3.98113 5.47357 8.7831 9.01338 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 9.61454 9.42801 4.46929 12.6737 10.3757 6.03081 numMergedOcc 0
21 mol 235 unq 1 iso 0 dist 9.61454 9.42801 4.46929 8.47779 10.9793 7.41433 numMergedOcc 0
22 mol 235 unq 2 iso 0 dist 8.38547 9.20504 8.72703 5.66713 10.9225 8.85214 numMergedOcc 0
23 mol 235 unq 3 iso 0 dist 8.38547 6.15704 10.5211 9.92254 14.4755 6.03081 numMergedOcc 0
24 mol 235 unq 4 iso 0 dist 8.38547 6.15704 10.5211 5.66713 10.9225 5.1874 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 6.81644 7.13476 6.76489 4.03312 10.4087 8.30024 numMergedOcc 0
26 mol 243 unq 1 iso 0 dist 6.81644 7.13476 6.76489 9.0802 13.0938 8.20943 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 5.76223 9.18386 11.4255 6.59125 10.2238 7.89938 numMergedOcc 0
