0 mol 35 unq 0 iso 0 dist 5.28675 6.17207 5.70699 14.8577 11.779 9.03313 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 9.75377 10.3247 9.77509 11.4797 4.679 8.35933 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 9.75377 7.22319 7.09336 11.4797 4.679 6.18083 numMergedOcc 0
3 mol 41 unq 2 iso 0 dist 6.75602 7.22319 9.88728 11.4797 13.5907 6.18083 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.84944 10.9311 7.32236 9.79678 4.22382 9.36759 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.84944 10.9311 7.32236 10.5349 8.43173 5.0553 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 7.21995 6.43999 7.32236 11.2099 4.22382 9.36759 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 7.21995 6.43999 7.32236 11.0067 8.43173 5.0553 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 7.57394 9.93652 9.71134 11.9912 11.0751 8.96872 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 9.65031 10.9552 9.17101 10.149 4.57152 9.87656 numMergedOcc 0
10 mol 152 unq 1 iso 0 dist 9.65031 10.9552 9.17101 11.0065 10.0143 5.35463 numMergedOcc 0
11 mol 152 unq 2 iso 0 dist 8.51844 6.05258 9.17101 11.7308 4.57152 9.87656 numMergedOcc 0
12 mol 152 unq 3 iso 0 dist 8.51844 6.05258 9.17101 10.8934 10.0143 5.35463 numMergedOcc 0
13 mol 165 unq 0 iso 0 dist 5.99596 9.93041 8.01191 9.13163 5.54803 4.46402 numMergedOcc 0
14 mol 174 unq 0 iso 0 dist 8.16228 14.5347 9.79225 14.2802 9.22406 4.97597 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 6.72718 11.4764 8.11956 9.80138 3.82682 5.84716 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 6.72718 11.4764 8.11956 5.65146 4.84679 5.88987 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 6.2016 7.71442 5.90008 8.40971 9.45543 9.99252 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 8.05949 11.533 6.93215 11.7525 11.8119 8.86708 numMergedOcc 0
19 mol 210 unq 1 iso 0 dist 8.05949 11.533 6.93215 17.1927 12.1997 5.86875 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 6.39087 3.96711 7.01486 12.2225 10.8016 9.92712 numMergedOcc 0
21 mol 220 unq 1 iso 0 dist 9.86144 5.71318 7.01486 15.0484 10.8016 9.92712 numMergedOcc 0
22 mol 240 unq 0 iso 0 dist 7.19218 3.72896 6.91279 11.8657 6.66143 9.52824 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 7.58385 10.8524 9.66703 20.1519 17.7278 9.53489 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 6.57444 16.3701 9.96942 15.2986 9.64323 9.27812 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 9.39714 8.85331 9.96942 15.2815 9.64323 9.27812 numMergedOcc 0
