0 mol 7 unq 0 iso 0 dist 7.21619 8.75206 8.80762 13.2517 11.7002 5.99459 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 5.87266 5.41626 7.05346 5.18338 4.3947 8.30653 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.60462 7.06965 7.05346 13.0307 4.3947 8.30653 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 5.78238 9.59761 6.60423 10.1898 4.47891 7.95042 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 8.10697 5.39129 7.05737 8.62204 5.26748 9.19165 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.33162 9.97169 8.44903 9.04174 4.69849 6.66407 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 9.41473 6.6796 9.93832 9.23033 4.55347 6.6263 numMergedOcc 0
7 mol 43 unq 2 iso 0 dist 9.41473 10.2523 8.60739 9.23033 4.55347 6.75943 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.59232 6.71593 8.85586 7.91605 5.50891 5.5087 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 6.59232 6.71593 8.85586 6.43707 4.75954 6.08682 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 6.59232 5.72472 5.16364 5.79157 5.56296 8.72682 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 6.59232 5.72472 5.16364 10.5064 6.69436 6.45841 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 6.59232 5.72472 5.16364 7.91605 5.50891 5.61588 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 6.59232 5.72472 5.16364 6.43707 4.75954 7.83244 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 7.5344 8.25445 8.86329 9.5782 5.30999 9.27976 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 9.07229 10.6381 8.41611 12.9811 9.05786 7.36975 numMergedOcc 0
16 mol 143 unq 1 iso 0 dist 9.07229 10.6381 8.41611 11.5131 6.16103 5.40637 numMergedOcc 0
17 mol 143 unq 2 iso 0 dist 8.98581 4.98373 7.63338 6.45477 3.75378 7.36975 numMergedOcc 0
18 mol 143 unq 3 iso 0 dist 8.98581 4.98373 7.63338 9.95629 8.4697 5.40637 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.51006 10.568 7.20574 9.82338 8.58039 6.61112 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 9.05979 10.591 7.24795 17.1539 9.40383 8.73533 numMergedOcc 0
21 mol 210 unq 0 iso 0 dist 8.53457 13.2569 7.63018 13.4046 6.75621 8.63693 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 9.71415 13.4459 8.86175 18.986 13.4147 8.75536 numMergedOcc 0
23 mol 218 unq 1 iso 0 dist 9.71415 13.3081 6.29511 18.986 13.4147 7.33709 numMergedOcc 0
24 mol 223 unq 0 iso 0 dist 6.82737 4.67731 6.13306 8.85178 4.40141 6.42257 numMergedOcc 0
25 mol 223 unq 1 iso 0 dist 6.82737 4.67731 6.13306 9.73123 9.63911 9.33543 numMergedOcc 0
26 mol 223 unq 2 iso 0 dist 6.80967 7.19485 6.13306 5.50267 4.40141 6.42257 numMergedOcc 0
27 mol 223 unq 3 iso 0 dist 6.80967 7.19485 6.13306 15.0085 9.63911 9.33543 numMergedOcc 0
28 mol 227 unq 0 iso 0 dist 5.05201 9.08827 8.38865 10.7273 7.3164 5.23634 numMergedOcc 0
29 mol 227 unq 1 iso 0 dist 5.05201 5.70988 5.4694 10.7273 7.3164 6.91318 numMergedOcc 0
30 mol 232 unq 0 iso 0 dist 6.29118 4.90814 7.83711 9.11418 8.03712 6.71524 numMergedOcc 0
31 mol 234 unq 0 iso 0 dist 4.7359 6.16697 7.5366 12.4723 11.0592 7.81215 numMergedOcc 0
32 mol 248 unq 0 iso 0 dist 8.46518 4.53213 6.17052 7.90773 7.14182 9.05018 numMergedOcc 0
33 mol 252 unq 0 iso 0 dist 6.88874 5.26867 6.86945 4.54745 4.34126 7.15764 numMergedOcc 0
