0 mol 7 unq 0 iso 0 dist 6.0323 7.15434 5.70161 11.2706 12.2471 7.10621 7.29541 10.0158 5.72491 5.44992 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.79533 9.31271 16.5607 10.3326 18.2908 9.04767 9.3765 17.4819 9.58855 10.6873 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 6.72533 6.39243 4.96555 15.2831 13.7283 9.51761 6.43155 11.1909 7.55766 12.4713 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 6.72533 6.39243 4.96555 9.30561 11.0264 7.3094 6.43155 11.1909 7.55766 6.48196 numMergedOcc 0
4 mol 18 unq 2 iso 0 dist 8.29216 9.1715 4.96555 17.8306 13.7283 9.51761 10.2305 11.1909 7.55766 12.4713 numMergedOcc 0
5 mol 18 unq 3 iso 0 dist 8.29216 9.1715 4.96555 14.3582 11.0264 7.3094 10.2305 11.1909 7.55766 6.48196 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 7.53564 9.17086 10.323 5.90113 9.74445 8.80331 8.33667 15.1191 9.93832 9.06158 numMergedOcc 0
7 mol 52 unq 0 iso 0 dist 9.67023 5.26018 6.86126 12.8491 15.6506 9.80098 11.8848 15.1166 9.66501 4.88603 numMergedOcc 0
8 mol 52 unq 1 iso 0 dist 9.67023 5.26018 6.86126 10.3287 12.0739 7.34143 11.8848 15.1166 9.66501 12.277 numMergedOcc 0
9 mol 52 unq 2 iso 0 dist 6.86785 7.1203 6.55558 5.92851 11.8328 9.80098 8.65709 12.1388 9.66501 4.88603 numMergedOcc 0
10 mol 52 unq 3 iso 0 dist 6.86785 7.1203 6.55558 6.03647 9.90304 7.34143 8.65709 12.1388 9.66501 12.277 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 7.84699 8.124 5.2774 13.4367 6.89722 6.19304 16.0036 13.0088 8.73253 8.26458 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 8.40844 8.124 5.44275 13.4367 7.26679 6.19304 16.0036 10.5067 8.73253 8.26458 numMergedOcc 0
13 mol 73 unq 2 iso 0 dist 6.99156 8.124 8.0624 13.4367 10.1503 6.19304 16.0036 14.8476 8.73253 8.26458 numMergedOcc 0
14 mol 73 unq 3 iso 0 dist 7.02351 8.16299 11.2674 10.3774 7.26679 8.70481 11.9686 17.0516 8.85586 14.8866 numMergedOcc 0
15 mol 73 unq 4 iso 0 dist 7.02351 8.16299 11.2674 10.3774 7.26679 8.70481 11.4934 12.9368 7.11 8.05119 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 7.26463 8.88255 9.35307 10.5726 15.5753 8.73993 6.89245 12.4974 7.77116 3.78311 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 7.8034 9.33945 8.25445 12.3624 11.439 8.40312 11.8905 7.5344 8.86329 5.89022 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 8.58709 6.21273 4.90657 5.1021 9.8711 9.23153 6.71715 6.50846 5.45036 6.17628 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 8.58709 6.21273 4.90657 5.1021 9.8711 9.23153 10.938 14.8113 9.97586 14.0253 numMergedOcc 0
20 mol 220 unq 2 iso 0 dist 8.58709 6.21273 4.90657 6.29601 12.6756 8.24498 6.71715 6.50846 5.45036 10.4136 numMergedOcc 0
21 mol 220 unq 3 iso 0 dist 8.58709 6.21273 4.90657 6.29601 12.6756 8.24498 10.938 14.8113 9.97586 6.20511 numMergedOcc 0
22 mol 222 unq 0 iso 0 dist 7.10689 8.7419 8.81265 5.01062 8.7347 6.00706 7.26742 12.5498 7.862 6.42798 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 7.99145 7.71761 11.4528 5.841 9.17826 7.55216 8.14937 14.5658 5.87815 10.6244 numMergedOcc 0
24 mol 230 unq 0 iso 0 dist 5.00735 5.62804 7.07028 6.33989 8.43766 6.7547 10.1088 10.3524 6.41286 6.20661 numMergedOcc 0
25 mol 230 unq 1 iso 0 dist 6.73755 5.62804 5.26217 6.33989 10.6474 6.7547 10.1088 10.4504 6.41286 6.20661 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 6.59521 8.21585 9.22664 5.13233 8.58088 6.42289 12.2193 14.7484 7.99477 7.42673 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 6.59521 8.21585 9.22664 5.13233 8.58088 6.42289 8.45446 13.7217 7.86627 6.44209 numMergedOcc 0
