0 mol 25 unq 0 iso 0 dist 7.05196 4.69295 8.07318 11.6045 7.44277 9.7883 numMergedOcc 0
1 mol 25 unq 0 iso 1 dist 7.05196 11.6045 7.44277 4.69295 8.07318 9.7883 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 6.66407 11.4153 9.50614 4.96926 8.34145 12.7961 numMergedOcc 0
3 mol 43 unq 0 iso 1 dist 6.66407 4.96926 8.34145 11.4153 9.50614 12.7961 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 9.76379 5.09159 8.64934 10.867 8.7515 6.48468 numMergedOcc 0
5 mol 79 unq 0 iso 1 dist 9.76379 10.867 8.7515 5.09159 8.64934 6.48468 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.11586 16.9857 8.75345 7.63763 9.79643 17.5596 numMergedOcc 0
7 mol 95 unq 0 iso 1 dist 9.11586 7.63763 9.79643 16.9857 8.75345 17.5596 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 7.21137 4.3093 5.03818 7.94891 6.40171 8.2248 numMergedOcc 0
9 mol 205 unq 0 iso 1 dist 7.21137 7.94891 6.40171 4.3093 5.03818 8.2248 numMergedOcc 0
10 mol 205 unq 1 iso 0 dist 8.4844 8.90569 5.03818 6.37317 6.40171 8.2248 numMergedOcc 0
11 mol 205 unq 1 iso 1 dist 8.4844 6.37317 6.40171 8.90569 5.03818 8.2248 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 5.23634 4.664 8.85955 4.1511 6.09335 5.30101 numMergedOcc 0
13 mol 227 unq 0 iso 1 dist 5.23634 4.1511 6.09335 4.664 8.85955 5.30101 numMergedOcc 0
14 mol 227 unq 1 iso 0 dist 6.91318 8.49509 8.85955 4.69247 6.09335 5.30101 numMergedOcc 0
15 mol 227 unq 1 iso 1 dist 6.91318 4.69247 6.09335 8.49509 8.85955 5.30101 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 8.19317 9.72447 6.03081 12.983 7.41433 5.73785 numMergedOcc 0
17 mol 235 unq 0 iso 1 dist 8.19317 12.983 7.41433 9.72447 6.03081 5.73785 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 5.1823 4.21867 6.03081 5.88852 7.41433 5.73785 numMergedOcc 0
19 mol 235 unq 1 iso 1 dist 5.1823 5.88852 7.41433 4.21867 6.03081 5.73785 numMergedOcc 0
20 mol 235 unq 2 iso 0 dist 6.29377 10.3462 8.85214 9.72447 5.1874 5.20556 numMergedOcc 0
21 mol 235 unq 2 iso 1 dist 6.29377 9.72447 5.1874 10.3462 8.85214 5.20556 numMergedOcc 0
22 mol 235 unq 3 iso 0 dist 5.70635 4.5022 8.85214 4.21867 5.1874 5.20556 numMergedOcc 0
23 mol 235 unq 3 iso 1 dist 5.70635 4.21867 5.1874 4.5022 8.85214 5.20556 numMergedOcc 0
24 mol 243 unq 0 iso 0 dist 8.69318 10.2068 8.30024 5.74165 8.20943 6.27924 numMergedOcc 0
25 mol 243 unq 0 iso 1 dist 8.69318 5.74165 8.20943 10.2068 8.30024 6.27924 numMergedOcc 0
26 mol 264 unq 0 iso 0 dist 5.90924 5.71153 9.78237 5.70542 9.70101 8.39725 numMergedOcc 0
27 mol 264 unq 0 iso 1 dist 5.90924 5.70542 9.70101 5.71153 9.78237 8.39725 numMergedOcc 0
28 mol 264 unq 1 iso 0 dist 5.90924 5.71153 9.78237 6.87635 9.95798 5.23295 numMergedOcc 0
29 mol 264 unq 1 iso 1 dist 5.90924 6.87635 9.95798 5.71153 9.78237 5.23295 numMergedOcc 0
30 mol 264 unq 1 iso 0 dist 5.90924 5.70542 9.70101 6.87635 9.95798 6.00586 numMergedOcc 0
31 mol 264 unq 1 iso 1 dist 5.90924 6.87635 9.95798 5.70542 9.70101 6.00586 numMergedOcc 0
32 mol 264 unq 2 iso 0 dist 5.90058 12.6872 9.78237 9.63145 9.70101 8.39725 numMergedOcc 0
33 mol 264 unq 2 iso 1 dist 5.90058 9.63145 9.70101 12.6872 9.78237 8.39725 numMergedOcc 0
34 mol 264 unq 3 iso 0 dist 5.90058 12.6872 9.78237 12.9337 9.95798 5.23295 numMergedOcc 0
35 mol 264 unq 3 iso 1 dist 5.90058 12.9337 9.95798 12.6872 9.78237 5.23295 numMergedOcc 0
36 mol 264 unq 3 iso 0 dist 5.90058 9.63145 9.70101 12.9337 9.95798 6.00586 numMergedOcc 0
37 mol 264 unq 3 iso 1 dist 5.90058 12.9337 9.95798 9.63145 9.70101 6.00586 numMergedOcc 0
38 mol 264 unq 4 iso 0 dist 9.58916 6.56539 9.78237 10.1301 9.70101 8.39725 numMergedOcc 0
39 mol 264 unq 4 iso 1 dist 9.58916 10.1301 9.70101 6.56539 9.78237 8.39725 numMergedOcc 0
40 mol 264 unq 5 iso 0 dist 9.58916 6.56539 9.78237 4.76241 9.95798 5.23295 numMergedOcc 0
41 mol 264 unq 5 iso 1 dist 9.58916 4.76241 9.95798 6.56539 9.78237 5.23295 numMergedOcc 0
42 mol 264 unq 5 iso 0 dist 9.58916 10.1301 9.70101 4.76241 9.95798 6.00586 numMergedOcc 0
43 mol 264 unq 5 iso 1 dist 9.58916 4.76241 9.95798 10.1301 9.70101 6.00586 numMergedOcc 0
44 mol 292 unq 0 iso 0 dist 9.74118 5.94 6.22943 9.18492 9.31056 5.99377 numMergedOcc 0
45 mol 292 unq 0 iso 1 dist 9.74118 9.18492 9.31056 5.94 6.22943 5.99377 numMergedOcc 0
