0 mol 13 unq 0 iso 0 dist 6.6621 6.48985 5.4424 5.83624 3.53348 4.43066 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 9.72515 4.07703 9.46036 9.67564 11.5376 5.61567 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 9.72515 4.07703 9.46036 12.3646 11.3023 8.46981 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.61405 11.2167 6.70925 6.22872 5.17759 9.762 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.44186 4.01477 6.59382 10.7892 14.2039 9.68629 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 6.29966 7.65804 5.52402 10.9431 4.91593 9.14068 numMergedOcc 0
6 mol 108 unq 1 iso 0 dist 6.29966 9.35984 6.79804 10.9431 4.91593 7.90433 numMergedOcc 0
7 mol 108 unq 2 iso 0 dist 9.31725 14.3699 5.52402 10.1441 4.91593 9.14068 numMergedOcc 0
8 mol 108 unq 3 iso 0 dist 9.31725 11.9597 6.79804 10.1441 4.91593 7.90433 numMergedOcc 0
9 mol 108 unq 4 iso 0 dist 9.57358 13.8903 5.52402 11.8948 4.91593 9.14068 numMergedOcc 0
10 mol 108 unq 5 iso 0 dist 9.57358 13.7036 6.79804 11.8948 4.91593 7.90433 numMergedOcc 0
11 mol 108 unq 6 iso 0 dist 5.38329 4.85222 5.52402 9.78697 4.91593 9.14068 numMergedOcc 0
12 mol 108 unq 7 iso 0 dist 5.38329 10.7411 6.79804 9.78697 4.91593 7.90433 numMergedOcc 0
13 mol 108 unq 8 iso 0 dist 7.62421 4.85222 7.57593 9.78697 6.23415 9.14068 numMergedOcc 0
14 mol 128 unq 0 iso 0 dist 9.05734 9.11986 5.4772 13.3137 8.1634 9.67042 numMergedOcc 0
15 mol 128 unq 1 iso 0 dist 9.05734 9.11986 5.4772 14.512 8.13018 7.95999 numMergedOcc 0
16 mol 128 unq 2 iso 0 dist 9.05734 9.29572 7.84607 13.3137 8.1634 9.01072 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 8.3311 9.11877 7.252 16.206 12.8252 7.93715 numMergedOcc 0
18 mol 192 unq 1 iso 0 dist 7.74423 11.9796 7.252 18.614 12.8252 7.93715 numMergedOcc 0
19 mol 196 unq 0 iso 0 dist 6.51568 9.19308 7.42783 4.48862 6.08875 8.76076 numMergedOcc 0
20 mol 196 unq 1 iso 0 dist 6.51568 9.19308 7.42783 9.17772 5.22098 4.36496 numMergedOcc 0
21 mol 196 unq 2 iso 0 dist 6.51568 9.19308 7.42783 15.2069 10.3324 7.34995 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 5.59164 6.16765 9.46728 10.1672 12.4194 8.56975 numMergedOcc 0
23 mol 255 unq 0 iso 0 dist 6.62375 13.2407 8.22083 11.702 5.14773 7.7177 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 8.13376 11.3955 7.97113 11.7827 10.2743 4.95855 numMergedOcc 0
25 mol 259 unq 1 iso 0 dist 8.13376 11.3955 7.97113 13.5447 11.46 7.72489 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 9.23807 13.2227 9.8799 18.9772 11.217 9.13546 numMergedOcc 0
27 mol 264 unq 1 iso 0 dist 9.23807 13.2227 9.8799 16.0964 9.42483 8.7365 numMergedOcc 0
28 mol 264 unq 2 iso 0 dist 8.49619 13.6237 9.8799 13.7338 11.217 9.13546 numMergedOcc 0
29 mol 264 unq 3 iso 0 dist 8.49619 13.6237 9.8799 15.1027 9.42483 8.7365 numMergedOcc 0
30 mol 283 unq 0 iso 0 dist 5.78449 7.85589 8.80418 12.636 10.5903 7.81241 numMergedOcc 0
31 mol 283 unq 1 iso 0 dist 5.78449 7.85589 8.80418 12.9844 9.41544 9.52445 numMergedOcc 0
32 mol 292 unq 0 iso 0 dist 9.83077 11.6428 8.92332 20.5237 16.0657 9.7061 numMergedOcc 0
33 mol 292 unq 1 iso 0 dist 8.45634 4.09108 8.92332 12.1075 16.0657 9.7061 numMergedOcc 0
