0 mol 91 unq 0 iso 0 dist 5.22576 7.48593 8.65409 6.39764 8.91354 13.7719 numMergedOcc 0
1 mol 91 unq 0 iso 1 dist 8.65409 7.48593 5.22576 13.7719 8.91354 6.39764 numMergedOcc 0
2 mol 148 unq 0 iso 0 dist 6.17633 4.52591 9.32264 8.47619 9.18753 12.407 numMergedOcc 0
3 mol 148 unq 0 iso 1 dist 9.32264 4.52591 6.17633 12.407 9.18753 8.47619 numMergedOcc 0
4 mol 150 unq 0 iso 0 dist 6.20295 4.62267 9.34249 8.33704 9.15244 12.3632 numMergedOcc 0
5 mol 150 unq 0 iso 1 dist 9.34249 4.62267 6.20295 12.3632 9.15244 8.33704 numMergedOcc 0
6 mol 168 unq 0 iso 0 dist 9.63035 7.74873 7.19585 6.26263 8.72323 5.10257 numMergedOcc 0
7 mol 168 unq 0 iso 1 dist 7.19585 7.74873 9.63035 5.10257 8.72323 6.26263 numMergedOcc 0
8 mol 168 unq 1 iso 0 dist 9.63035 18.276 8.66519 6.26263 8.72323 16.2743 numMergedOcc 0
9 mol 168 unq 1 iso 1 dist 8.66519 18.276 9.63035 16.2743 8.72323 6.26263 numMergedOcc 0
10 mol 168 unq 2 iso 0 dist 9.63035 17.5958 8.35731 6.26263 8.72323 15.4709 numMergedOcc 0
11 mol 168 unq 2 iso 1 dist 8.35731 17.5958 9.63035 15.4709 8.72323 6.26263 numMergedOcc 0
12 mol 168 unq 1 iso 0 dist 7.19585 13.9418 8.66519 5.10257 8.72323 16.2743 numMergedOcc 0
13 mol 168 unq 1 iso 1 dist 8.66519 13.9418 7.19585 16.2743 8.72323 5.10257 numMergedOcc 0
14 mol 168 unq 2 iso 0 dist 7.19585 14.4854 8.35731 5.10257 8.72323 15.4709 numMergedOcc 0
15 mol 168 unq 2 iso 1 dist 8.35731 14.4854 7.19585 15.4709 8.72323 5.10257 numMergedOcc 0
16 mol 168 unq 2 iso 0 dist 8.66519 4.23264 8.35731 16.2743 8.72323 15.4709 numMergedOcc 0
17 mol 168 unq 2 iso 1 dist 8.35731 4.23264 8.66519 15.4709 8.72323 16.2743 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 7.78385 6.61246 7.17789 4.62781 9.2254 10.2242 numMergedOcc 0
19 mol 186 unq 0 iso 1 dist 7.17789 6.61246 7.78385 10.2242 9.2254 4.62781 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 9.12896 7.04918 8.63667 13.4281 9.52029 9.86864 numMergedOcc 0
21 mol 204 unq 0 iso 1 dist 8.63667 7.04918 9.12896 9.86864 9.52029 13.4281 numMergedOcc 0
22 mol 271 unq 0 iso 0 dist 7.90629 6.83746 9.01599 6.04262 9.50884 10.8455 numMergedOcc 0
23 mol 271 unq 0 iso 1 dist 9.01599 6.83746 7.90629 10.8455 9.50884 6.04262 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 6.92271 10.7983 8.62666 4.00063 8.15119 9.31316 numMergedOcc 0
25 mol 277 unq 0 iso 1 dist 8.62666 10.7983 6.92271 9.31316 8.15119 4.00063 numMergedOcc 0
26 mol 281 unq 0 iso 0 dist 8.80931 8.54551 9.83857 3.90611 6.58925 5.78711 numMergedOcc 0
27 mol 281 unq 0 iso 1 dist 9.83857 8.54551 8.80931 5.78711 6.58925 3.90611 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 8.92737 3.83551 7.15278 9.82894 6.37998 6.49126 numMergedOcc 0
29 mol 294 unq 0 iso 1 dist 7.15278 3.83551 8.92737 6.49126 6.37998 9.82894 numMergedOcc 0
