0 mol 5 unq 0 iso 0 dist 9.45559 8.27541 5.63302 11.0931 4.51071 6.94591 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 7.4332 8.27541 5.70163 11.0931 3.81534 6.94591 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 5.85081 11.9469 8.15337 8.01055 4.07023 6.3 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 5.85081 11.9469 8.15337 8.61976 7.19188 5.93208 numMergedOcc 0
4 mol 28 unq 0 iso 0 dist 7.7871 7.91577 8.47637 14.0551 10.1805 8.33169 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.81735 8.09226 6.89022 10.7445 4.04498 8.76844 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 7.61377 6.20622 6.52537 9.11512 3.90956 9.52436 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 7.4113 5.27337 5.45716 13.4969 10.9333 9.68809 numMergedOcc 0
8 mol 114 unq 1 iso 0 dist 8.53631 10.7729 5.45716 12.7251 10.9333 9.68809 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 9.07315 13.95 7.78215 22.3146 15.2106 9.17101 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 6.7638 9.23684 5.14196 15.8196 11.719 7.45761 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 7.95917 11.533 9.41473 8.05949 4.68656 6.93215 numMergedOcc 0
12 mol 254 unq 0 iso 0 dist 5.83039 9.92619 6.56151 9.54511 5.9731 9.56058 numMergedOcc 0
13 mol 254 unq 1 iso 0 dist 6.74364 9.92619 8.3417 9.54511 3.69576 9.56058 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 7.36137 5.62596 8.53393 11.5802 13.664 9.96942 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 6.83784 9.61883 8.53393 18.1766 13.664 9.96942 numMergedOcc 0
16 mol 266 unq 2 iso 0 dist 4.95415 5.62596 7.24165 11.5802 13.7979 9.96942 numMergedOcc 0
17 mol 266 unq 3 iso 0 dist 6.38519 9.61883 7.24165 18.1766 13.7979 9.96942 numMergedOcc 0
18 mol 268 unq 0 iso 0 dist 7.40323 3.28649 6.38058 5.94741 6.07203 7.30388 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 5.38739 9.97273 9.74797 12.7559 12.6455 4.1631 numMergedOcc 0
20 mol 286 unq 0 iso 0 dist 8.08382 6.06584 6.87255 6.83763 5.76615 9.91859 numMergedOcc 0
