0 mol 16 unq 0 iso 0 dist 9.30471 10.3757 7.03948 3.83262 6.42835 9.87867 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.30471 10.3757 7.03948 5.7598 6.57331 4.68733 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.75668 4.97497 8.68586 11.5793 9.86334 8.84224 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 7.89424 9.74458 7.96497 3.89663 7.39665 7.39155 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 8.4143 7.14908 9.02278 6.53445 6.21799 5.5067 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 8.4143 7.14908 9.02278 6.27856 5.03251 4.01021 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 8.4143 7.14908 9.02278 11.2873 7.66093 6.40102 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 8.77218 10.8271 8.97793 14.6511 9.85905 9.21694 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 8.77218 13.1819 8.19682 14.6511 9.85905 4.00608 numMergedOcc 0
9 mol 76 unq 2 iso 0 dist 7.46657 6.14439 6.21982 6.38237 6.72869 4.00608 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 9.41191 7.32599 5.87358 9.45977 7.07971 5.15674 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 7.9258 10.8105 7.76729 6.27754 6.24825 5.78043 numMergedOcc 0
12 mol 127 unq 0 iso 0 dist 9.89053 5.24695 6.63981 4.0787 7.79505 6.15949 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 9.16358 5.0903 8.79571 7.07082 7.21868 5.67107 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 6.48328 5.0903 5.42582 9.80637 9.33924 6.0991 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 6.48328 5.0903 5.42582 7.07082 7.93372 5.67107 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 9.63185 6.70227 8.96511 11.4463 9.11204 5.87125 numMergedOcc 0
17 mol 195 unq 0 iso 0 dist 7.04524 10.9358 8.36117 6.61895 9.03441 9.33403 numMergedOcc 0
18 mol 195 unq 1 iso 0 dist 7.04524 7.60158 6.77578 6.61895 9.03441 4.191 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 9.44947 12.7783 5.90931 14.13 7.9133 11.2106 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 8.52924 15.3503 9.19704 10.3649 6.52816 13.4094 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 9.92165 4.40728 6.97182 14.5969 7.46481 11.357 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 9.92165 5.75872 6.1175 14.5969 7.46481 10.9581 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 8.27093 6.92493 8.17891 5.92282 5.23634 4.09934 numMergedOcc 0
24 mol 227 unq 1 iso 0 dist 9.02226 9.72888 9.62609 5.92282 6.91318 11.5454 numMergedOcc 0
25 mol 227 unq 2 iso 0 dist 9.02226 6.92493 6.95902 5.92282 6.91318 4.09934 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 7.87233 4.71339 5.34718 16.5242 9.3206 13.0765 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 9.58767 10.8712 9.68513 6.20523 8.82351 5.99163 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 9.58767 8.92747 5.9216 6.20523 8.82351 4.40419 numMergedOcc 0
29 mol 241 unq 0 iso 0 dist 7.73213 6.83816 6.83797 10.7255 7.95042 12.0248 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 4.81916 6.20663 9.41725 9.31926 9.35539 7.07508 numMergedOcc 0
31 mol 277 unq 1 iso 0 dist 4.81916 6.20663 9.41725 13.1828 8.9682 18.3854 numMergedOcc 0
32 mol 277 unq 2 iso 0 dist 4.81916 6.20663 9.41725 10.6994 6.92711 16.1088 numMergedOcc 0
