0 mol 25 unq 0 iso 0 dist 9.58408 9.26742 11.8097 4.44274 9.43241 11.7614 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 7.36132 9.19647 6.47853 9.38745 9.0081 13.7743 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 7.84387 7.91538 5.05903 13.5343 9.99922 12.5445 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.60665 8.12417 7.34949 6.15635 5.25083 10.7172 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 7.60665 8.12417 7.34949 5.07989 8.7835 12.4393 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.15006 8.90417 4.19771 4.39945 5.09725 8.21723 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 8.6969 6.9902 12.7347 13.4058 8.48071 12.9344 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 9.18318 6.9902 12.0146 13.4058 6.48198 12.9344 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 7.94124 8.33541 12.7347 4.69745 8.48071 12.9344 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 5.92298 8.33541 12.0146 4.69745 6.48198 12.9344 numMergedOcc 0
10 mol 132 unq 0 iso 0 dist 6.13054 9.4827 4.90131 4.5649 9.57415 13.2789 numMergedOcc 0
11 mol 132 unq 1 iso 0 dist 6.13054 9.0788 13.8244 4.5649 9.57415 7.79845 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 7.16289 9.58272 5.21599 7.95074 9.17333 7.26891 numMergedOcc 0
13 mol 154 unq 1 iso 0 dist 9.3164 5.67578 5.21599 4.57254 9.17333 7.26891 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 9.44323 9.74021 6.72746 5.86817 8.36606 12.1971 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 9.41747 6.04508 9.81428 4.14391 6.55345 7.6168 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 9.41747 6.73104 6.38465 4.14391 6.55345 4.95155 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 6.07688 8.10832 11.0014 4.34513 9.4323 10.1306 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 5.15585 6.44327 6.30987 6.92811 7.10646 5.1498 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 5.15585 9.15362 11.661 6.92811 7.10646 11.4395 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 7.91542 9.77345 5.79398 5.05913 9.71606 13.5582 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 8.70264 9.79506 4.78629 5.72206 9.24896 7.37405 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 6.84692 8.6416 8.65126 5.3748 9.26044 12.1205 numMergedOcc 0
23 mol 284 unq 0 iso 0 dist 5.84481 9.5276 11.6996 4.29335 9.91812 8.45487 numMergedOcc 0
