0 mol 24 unq 0 iso 0 dist 6.36381 5.80023 7.27472 6.53276 4.44526 6.38336 9.49646 3.73215 8.87744 4.5711 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.36381 5.80023 7.27472 6.81998 9.586 6.7828 9.49646 3.73215 8.87744 12.6707 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 5.33961 12.7318 7.54889 11.2155 9.25444 9.85543 10.5543 6.70343 5.2571 9.84703 numMergedOcc 0
3 mol 98 unq 1 iso 0 dist 5.33961 12.7318 7.54889 9.96465 8.46823 9.67482 10.5543 6.70343 5.2571 4.62494 numMergedOcc 0
4 mol 98 unq 2 iso 0 dist 5.33961 12.3835 7.78931 11.2155 9.25444 7.28361 10.5543 6.70343 8.7497 9.84703 numMergedOcc 0
5 mol 98 unq 3 iso 0 dist 5.33961 12.3835 7.78931 9.96465 8.46823 12.0974 10.5543 6.70343 8.7497 4.62494 numMergedOcc 0
6 mol 98 unq 4 iso 0 dist 8.3505 10.4417 5.92242 11.9783 9.84703 15.7178 7.34638 9.6331 7.02507 17.5956 numMergedOcc 0
7 mol 98 unq 5 iso 0 dist 8.3505 10.4417 5.92242 7.43001 4.62494 7.42446 7.34638 9.6331 7.02507 9.84743 numMergedOcc 0
8 mol 98 unq 6 iso 0 dist 8.3505 11.3628 5.2571 11.9783 9.84703 9.85543 14.2657 6.70343 7.54889 9.25444 numMergedOcc 0
9 mol 98 unq 7 iso 0 dist 8.3505 11.3628 5.2571 7.43001 4.62494 9.67482 14.2657 6.70343 7.54889 8.46823 numMergedOcc 0
10 mol 98 unq 8 iso 0 dist 8.3505 13.9599 8.7497 11.9783 9.84703 7.28361 14.2657 6.70343 7.78931 9.25444 numMergedOcc 0
11 mol 98 unq 9 iso 0 dist 8.3505 13.9599 8.7497 7.43001 4.62494 12.0974 14.2657 6.70343 7.78931 8.46823 numMergedOcc 0
12 mol 98 unq 10 iso 0 dist 9.29816 14.676 7.54889 18.3829 9.25444 9.85543 12.9554 6.70343 5.2571 9.84703 numMergedOcc 0
13 mol 98 unq 11 iso 0 dist 9.29816 14.676 7.54889 13.7832 8.46823 9.67482 12.9554 6.70343 5.2571 4.62494 numMergedOcc 0
14 mol 98 unq 12 iso 0 dist 9.29816 16.3389 7.78931 18.3829 9.25444 7.28361 12.9554 6.70343 8.7497 9.84703 numMergedOcc 0
15 mol 98 unq 13 iso 0 dist 9.29816 16.3389 7.78931 13.7832 8.46823 12.0974 12.9554 6.70343 8.7497 4.62494 numMergedOcc 0
16 mol 98 unq 14 iso 0 dist 5.08983 7.1452 7.54889 9.51607 9.25444 9.85543 9.58039 6.70343 5.2571 9.84703 numMergedOcc 0
17 mol 98 unq 15 iso 0 dist 5.08983 7.1452 7.54889 12.5752 8.46823 9.67482 9.58039 6.70343 5.2571 4.62494 numMergedOcc 0
18 mol 98 unq 16 iso 0 dist 5.08983 4.96747 7.78931 9.51607 9.25444 7.28361 9.58039 6.70343 8.7497 9.84703 numMergedOcc 0
19 mol 98 unq 17 iso 0 dist 5.08983 4.96747 7.78931 12.5752 8.46823 12.0974 9.58039 6.70343 8.7497 4.62494 numMergedOcc 0
20 mol 112 unq 0 iso 0 dist 4.77996 4.34071 5.56994 6.43704 6.11407 5.76986 9.80187 5.11 9.05166 8.72725 numMergedOcc 0
21 mol 129 unq 0 iso 0 dist 6.53559 6.43966 5.51197 4.92611 6.34626 4.92472 8.23699 5.94312 6.69691 10.0995 numMergedOcc 0
22 mol 129 unq 1 iso 0 dist 6.53559 6.43966 5.51197 4.92611 6.34626 4.92472 7.90844 9.74141 8.86944 11.4468 numMergedOcc 0
23 mol 129 unq 2 iso 0 dist 8.09774 5.56946 5.51197 6.15789 6.34626 4.92472 11.4776 5.94312 6.69691 10.0995 numMergedOcc 0
24 mol 129 unq 3 iso 0 dist 8.09774 5.56946 5.51197 6.15789 6.34626 4.92472 14.427 9.74141 8.86944 11.4468 numMergedOcc 0
25 mol 167 unq 0 iso 0 dist 6.48993 6.64464 6.84752 4.43501 8.86449 4.64019 8.77904 3.55199 7.68266 10.4753 numMergedOcc 0
26 mol 167 unq 1 iso 0 dist 6.48993 5.70785 7.86563 4.43501 8.86449 5.90938 8.77904 3.55199 7.6616 10.4753 numMergedOcc 0
27 mol 167 unq 2 iso 0 dist 6.48993 7.91498 7.02548 4.43501 8.86449 7.08726 11.1687 6.81449 7.20495 12.89 numMergedOcc 0
28 mol 167 unq 3 iso 0 dist 6.48993 7.91498 7.02548 4.43501 8.86449 7.08726 8.77904 3.55199 9.2289 10.4753 numMergedOcc 0
29 mol 184 unq 0 iso 0 dist 8.27396 4.41193 5.96423 12.4352 7.58375 8.08596 10.1839 5.33725 8.97589 10.6375 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 6.52441 11.7795 7.2793 6.33168 6.88127 10.5063 8.16639 3.47886 9.51091 9.90692 numMergedOcc 0
31 mol 186 unq 1 iso 0 dist 6.52441 11.7795 7.2793 6.33168 6.88127 10.5063 18.1478 12.5618 7.85184 14.7428 numMergedOcc 0
32 mol 188 unq 0 iso 0 dist 7.6482 6.04074 7.88013 5.15888 8.66624 8.77113 9.30803 3.68927 9.90062 11.5018 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 4.97796 4.56913 6.4611 6.70266 9.65868 9.5468 8.97249 13.5848 9.30212 7.77765 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 4.97796 4.56913 6.4611 5.15747 8.60027 6.70925 8.97249 13.5848 9.30212 10.0206 numMergedOcc 0
35 mol 274 unq 2 iso 0 dist 7.15079 4.37547 9.30212 9.95931 7.77765 9.5468 9.39896 13.5848 6.4611 9.65868 numMergedOcc 0
36 mol 292 unq 0 iso 0 dist 5.72473 8.04474 7.20674 6.08322 8.62162 8.83082 12.7549 9.14614 8.38121 10.8369 numMergedOcc 0
