0 mol 30 unq 0 iso 0 dist 8.609 10.7721 6.95343 3.65941 6.74179 8.74649 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 6.18305 12.2635 9.79143 4.21749 8.68662 12.8099 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 6.18305 12.2635 9.79143 5.65986 7.4369 10.4668 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 9.99155 13.7562 9.14563 8.14688 7.93281 7.64117 numMergedOcc 0
4 mol 74 unq 1 iso 0 dist 9.99155 11.4327 6.33741 8.14688 7.93281 4.40012 numMergedOcc 0
5 mol 86 unq 0 iso 0 dist 8.88225 12.2577 6.81209 6.62266 7.90423 11.0058 numMergedOcc 0
6 mol 86 unq 1 iso 0 dist 9.49308 14.195 6.81209 3.88769 7.90423 11.0058 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 9.72689 12.3773 6.066 10.0429 7.80898 6.29943 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 7.74197 4.95463 6.066 11.151 7.80898 6.29943 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.18763 5.4578 9.70093 5.92411 8.95212 10.9729 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 5.63005 5.4578 6.69217 5.92411 7.64052 10.9729 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 5.82404 6.00706 4.51266 11.5628 8.77023 13.2024 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 9.84952 10.7508 8.47008 7.19461 6.64173 7.11838 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 9.84952 10.7508 8.47008 9.77747 9.01624 8.25265 numMergedOcc 0
14 mol 181 unq 2 iso 0 dist 9.84952 10.7508 8.47008 10.0615 9.55105 5.42919 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.03995 10.8176 8.64379 11.8169 7.2793 7.32479 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 8.03995 10.8176 8.64379 14.1849 9.51091 6.54014 numMergedOcc 0
17 mol 186 unq 2 iso 0 dist 8.03995 10.8176 8.64379 3.85767 7.85184 9.61273 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 7.63036 7.11627 6.42016 3.58901 7.41662 4.16334 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 5.96555 5.47125 6.52987 6.96644 6.52816 11.2311 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 7.86368 11.1368 6.35438 9.8663 7.81215 4.76962 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 7.36905 5.63694 8.29556 3.63202 5.90924 4.46882 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 9.65265 12.3501 8.11169 18.3627 9.30212 10.5817 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 9.65265 12.3501 8.11169 11.4981 6.4611 14.0768 numMergedOcc 0
24 mol 274 unq 2 iso 0 dist 9.65265 13.1822 8.73167 18.3627 9.30212 11.8445 numMergedOcc 0
25 mol 274 unq 3 iso 0 dist 9.65265 13.1822 8.73167 11.4981 6.4611 10.2248 numMergedOcc 0
