0 mol 15 unq 0 iso 0 dist 7.87072 6.16274 4.74688 9.55181 4.41883 6.8318 numMergedOcc 0
1 mol 15 unq 0 iso 1 dist 7.87072 9.55181 4.41883 6.16274 4.74688 6.8318 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.58806 9.27448 7.15972 9.07927 12.1122 6.23352 numMergedOcc 0
3 mol 25 unq 0 iso 1 dist 8.58806 9.07927 12.1122 9.27448 7.15972 6.23352 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 8.58806 9.27448 7.15972 8.50987 14.3338 9.85159 numMergedOcc 0
5 mol 25 unq 1 iso 1 dist 8.58806 8.50987 14.3338 9.27448 7.15972 9.85159 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 8.58806 9.07927 12.1122 8.50987 14.3338 4.51512 numMergedOcc 0
7 mol 25 unq 1 iso 1 dist 8.58806 8.50987 14.3338 9.07927 12.1122 4.51512 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.07638 8.85981 8.60018 9.37314 5.96946 7.04501 numMergedOcc 0
9 mol 73 unq 0 iso 1 dist 8.07638 9.37314 5.96946 8.85981 8.60018 7.04501 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 6.79787 8.85981 7.06343 9.37314 3.27963 7.04501 numMergedOcc 0
11 mol 73 unq 1 iso 1 dist 6.79787 9.37314 3.27963 8.85981 7.06343 7.04501 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 4.3761 9.58693 8.91618 9.48388 12.3835 17.7405 numMergedOcc 0
13 mol 98 unq 0 iso 1 dist 4.3761 9.48388 12.3835 9.58693 8.91618 17.7405 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 5.84583 9.58693 12.9994 9.48388 4.96747 17.7405 numMergedOcc 0
15 mol 98 unq 1 iso 1 dist 5.84583 9.48388 4.96747 9.58693 12.9994 17.7405 numMergedOcc 0
16 mol 135 unq 0 iso 0 dist 6.29701 9.13451 8.13139 9.171 5.88534 6.57193 numMergedOcc 0
17 mol 135 unq 0 iso 1 dist 6.29701 9.171 5.88534 9.13451 8.13139 6.57193 numMergedOcc 0
18 mol 197 unq 0 iso 0 dist 8.05227 7.18765 7.56497 7.41091 5.66137 5.43601 numMergedOcc 0
19 mol 197 unq 0 iso 1 dist 8.05227 7.41091 5.66137 7.18765 7.56497 5.43601 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 8.17234 9.48923 9.29848 9.67544 6.21233 5.46031 numMergedOcc 0
21 mol 229 unq 0 iso 1 dist 8.17234 9.67544 6.21233 9.48923 9.29848 5.46031 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 5.67249 8.58958 10.3064 7.17987 6.50055 5.88703 numMergedOcc 0
23 mol 234 unq 0 iso 1 dist 5.67249 7.17987 6.50055 8.58958 10.3064 5.88703 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 5.40329 6.67907 4.32403 6.0087 4.38595 7.43758 numMergedOcc 0
25 mol 236 unq 0 iso 1 dist 5.40329 6.0087 4.38595 6.67907 4.32403 7.43758 numMergedOcc 0
26 mol 243 unq 0 iso 0 dist 9.6748 8.19458 16.7618 9.45133 16.2753 5.07774 numMergedOcc 0
27 mol 243 unq 0 iso 1 dist 9.6748 9.45133 16.2753 8.19458 16.7618 5.07774 numMergedOcc 0
28 mol 243 unq 1 iso 0 dist 8.71177 8.19458 11.0832 9.45133 9.97025 5.07774 numMergedOcc 0
29 mol 243 unq 1 iso 1 dist 8.71177 9.45133 9.97025 8.19458 11.0832 5.07774 numMergedOcc 0
30 mol 264 unq 0 iso 0 dist 5.03174 8.43682 5.21164 6.20796 6.12009 4.92077 numMergedOcc 0
31 mol 264 unq 0 iso 1 dist 5.03174 6.20796 6.12009 8.43682 5.21164 4.92077 numMergedOcc 0
32 mol 292 unq 0 iso 0 dist 6.84909 6.02089 9.83514 6.87804 8.04474 11.8061 numMergedOcc 0
33 mol 292 unq 0 iso 1 dist 6.84909 6.87804 8.04474 6.02089 9.83514 11.8061 numMergedOcc 0
