0 mol 7 unq 0 iso 0 dist 9.32945 6.22805 4.57188 17.0748 9.67498 13.9815 12.2255 13.158 9.67164 21.192 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 5.86243 7.57586 5.39129 9.83024 7.55357 11.7939 5.45205 8.62204 9.19165 9.37501 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 6.90646 8.14932 8.66921 6.24019 13.5835 9.86334 7.01498 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 8.14932 8.66921 9.82646 6.90646 9.3473 9.10915 7.01498 13.5835 9.86334 6.24019 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 6.17846 8.66921 5.33496 6.36389 6.08228 5.54343 7.01498 10.3556 9.86334 5.18166 numMergedOcc 0
5 mol 64 unq 3 iso 0 dist 6.17846 8.66921 5.33496 13.347 9.86958 13.7301 7.01498 10.3556 9.86334 15.822 numMergedOcc 0
6 mol 64 unq 4 iso 0 dist 6.08228 5.54343 5.33496 6.36389 6.17846 8.66921 5.18166 10.3556 9.86334 7.01498 numMergedOcc 0
7 mol 64 unq 5 iso 0 dist 6.08228 5.54343 5.33496 12.1186 9.86958 13.7301 5.18166 10.3556 9.86334 15.822 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.60363 6.30194 8.0624 16.6115 9.27331 14.6804 10.7557 14.4361 8.68662 22.377 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.60363 6.30194 8.0624 16.6115 9.27331 14.6804 11.1632 14.3455 7.4369 21.322 numMergedOcc 0
10 mol 219 unq 0 iso 0 dist 4.67452 8.09769 10.0509 8.93116 9.86916 16.9289 4.74338 8.38773 4.33238 13.1198 numMergedOcc 0
11 mol 219 unq 1 iso 0 dist 4.67452 7.24832 5.48556 8.93116 9.86916 14.6122 4.74338 8.38773 7.83604 13.1198 numMergedOcc 0
12 mol 223 unq 0 iso 0 dist 9.14789 9.94212 19.0281 9.20811 8.78739 17.4992 8.1388 16.4821 6.42257 13.6508 numMergedOcc 0
13 mol 223 unq 1 iso 0 dist 9.14789 9.94212 19.0281 9.20811 8.78739 17.4992 14.288 22.3512 9.33543 18.6147 numMergedOcc 0
14 mol 223 unq 2 iso 0 dist 7.80764 9.94212 4.67731 7.75335 6.03408 9.52613 8.1388 8.85178 6.42257 11.7563 numMergedOcc 0
15 mol 223 unq 3 iso 0 dist 7.80764 9.94212 4.67731 7.75335 6.03408 9.52613 14.288 9.73123 9.33543 8.87398 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 4.22519 7.76477 11.026 6.2559 9.11418 6.71524 10.2308 numMergedOcc 0
17 mol 232 unq 1 iso 0 dist 5.92175 7.47238 4.90814 9.1904 6.82688 10.8093 6.2559 9.11418 6.71524 13.0806 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 5.25969 8.73077 11.4871 8.41608 12.5187 9.46361 12.8888 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 5.78017 6.47376 5.34376 6.22487 6.12742 9.6147 4.91802 8.9352 6.35028 9.35656 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 6.12742 9.6147 5.34376 6.22487 5.78017 6.47376 9.35656 8.9352 6.35028 4.91802 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 8.08495 7.66291 8.39941 7.91838 9.3482 13.5103 10.9224 15.6243 7.80862 18.0605 numMergedOcc 0
