0 mol 0 unq 0 iso 0 dist 7.79297 11.9798 8.82102 4.16512 6.91778 10.9859 6.73401 9.67081 8.21826 5.8463 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.06275 5.71662 9.74445 5.33298 8.95682 10.7304 7.62357 9.02471 5.46849 10.4863 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 18.5048 9.74445 13.2914 8.95682 10.7304 16.9091 9.02471 5.46849 10.4863 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.96446 14.2688 7.86724 15.5614 8.18107 6.04547 12.0126 5.42067 3.68007 4.30488 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 9.96446 14.2688 7.86724 8.51558 5.9465 5.97684 12.0126 5.42067 3.68007 5.09449 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 6.71345 5.67441 8.42445 8.84017 6.84011 12.5697 11.5242 9.93438 13.1958 5.99273 numMergedOcc 0
6 mol 122 unq 0 iso 0 dist 8.47907 6.85647 8.33083 6.9595 9.23819 7.09391 12.1473 4.42563 12.2092 11.3935 numMergedOcc 0
7 mol 122 unq 1 iso 0 dist 8.47907 6.85647 8.33083 10.577 8.88537 10.4589 12.1473 4.42563 12.2092 8.90201 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 8.57514 8.21257 8.43584 7.35197 4.8668 5.42117 13.7017 9.31158 14.8213 9.43113 numMergedOcc 0
9 mol 205 unq 1 iso 0 dist 6.11505 5.03046 8.43584 5.68053 4.8668 5.42117 13.9601 9.31158 14.8213 9.43113 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 8.58471 15.9233 9.67457 5.06328 7.10826 11.6718 8.19655 6.85824 8.81074 4.73037 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 9.73691 11.0017 4.58599 10.1372 8.14332 11.5146 6.56215 9.09354 10.5963 13.1121 numMergedOcc 0
12 mol 213 unq 1 iso 0 dist 9.73691 11.0017 4.58599 10.1372 8.14332 11.5146 9.18934 4.66576 5.36904 6.78109 numMergedOcc 0
13 mol 213 unq 2 iso 0 dist 9.73691 10.4464 8.78568 10.1372 8.14332 10.693 6.56215 9.09354 13.711 13.1121 numMergedOcc 0
14 mol 213 unq 3 iso 0 dist 9.73691 10.4464 8.78568 10.1372 8.14332 10.693 9.18934 4.66576 4.84414 6.78109 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 8.82778 12.7518 6.37342 15.4125 8.84636 7.48655 10.7268 4.43499 7.72768 5.76503 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 9.13226 11.0263 9.696 8.85159 9.85289 14.679 8.82131 9.83622 10.9841 5.14522 numMergedOcc 0
