0 mol 7 unq 0 iso 0 dist 7.5298 14.06 7.21217 12.3221 6.09254 7.10621 16.9772 9.80599 5.44992 5.72491 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.94874 5.77391 7.21217 11.9671 6.09254 7.10621 11.1673 9.80599 5.44992 5.72491 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.58709 9.69698 9.74445 15.7652 10.323 8.80331 15.4386 15.1191 9.06158 9.93832 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.58709 9.69698 9.74445 15.8918 14.445 6.20293 15.4386 15.1191 9.06158 8.60739 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 7.53564 5.90113 9.74445 9.17086 10.323 8.80331 8.33667 15.1191 9.06158 9.93832 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 7.53564 5.90113 9.74445 10.615 14.445 6.20293 8.33667 15.1191 9.06158 8.60739 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 7.84699 13.4367 6.89722 10.1112 10.4716 9.96396 16.0036 13.0088 8.26458 7.04044 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 7.84699 13.4367 6.89722 8.124 5.2774 6.19304 16.0036 13.0088 8.26458 8.73253 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 7.84699 13.4367 6.89722 19.5696 13.9156 8.70481 24.6216 20.6347 14.8866 8.85586 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 7.84699 13.4367 6.89722 19.5696 13.9156 8.70481 19.8548 14.6904 8.05119 7.11 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 8.40844 5.33851 9.68526 10.1112 8.31041 9.38498 16.0036 10.5067 15.7304 7.04044 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 8.40844 13.4367 7.26679 10.1112 8.31041 9.96396 16.0036 10.5067 8.26458 7.04044 numMergedOcc 0
12 mol 73 unq 6 iso 0 dist 8.40844 13.4367 7.26679 8.124 5.44275 6.19304 16.0036 10.5067 8.26458 8.73253 numMergedOcc 0
13 mol 73 unq 7 iso 0 dist 8.40844 13.4367 7.26679 19.5696 11.2674 8.70481 24.6216 17.0516 14.8866 8.85586 numMergedOcc 0
14 mol 73 unq 8 iso 0 dist 8.40844 13.4367 7.26679 19.5696 11.2674 8.70481 19.8548 12.9368 8.05119 7.11 numMergedOcc 0
15 mol 73 unq 9 iso 0 dist 8.40844 15.7164 9.30776 10.1112 8.31041 9.75218 16.0036 10.5067 8.35241 7.04044 numMergedOcc 0
16 mol 73 unq 10 iso 0 dist 6.99156 5.33851 9.72442 10.1112 11.7069 9.38498 16.0036 14.8476 15.7304 7.04044 numMergedOcc 0
17 mol 73 unq 11 iso 0 dist 7.02351 13.6586 9.68526 11.0108 8.31041 9.38498 9.9619 10.5067 15.7304 7.04044 numMergedOcc 0
18 mol 73 unq 12 iso 0 dist 7.02351 10.3774 7.26679 11.0108 8.31041 9.96396 9.9619 10.5067 8.26458 7.04044 numMergedOcc 0
19 mol 73 unq 13 iso 0 dist 7.02351 10.3774 7.26679 10.9082 5.44275 6.19304 9.9619 10.5067 8.26458 8.73253 numMergedOcc 0
20 mol 73 unq 14 iso 0 dist 7.02351 10.3774 7.26679 8.16299 11.2674 8.70481 11.9686 17.0516 14.8866 8.85586 numMergedOcc 0
21 mol 73 unq 15 iso 0 dist 7.02351 10.3774 7.26679 8.16299 11.2674 8.70481 11.4934 12.9368 8.05119 7.11 numMergedOcc 0
22 mol 73 unq 16 iso 0 dist 7.02351 4.15333 9.30776 11.0108 8.31041 9.75218 9.9619 10.5067 8.35241 7.04044 numMergedOcc 0
23 mol 73 unq 17 iso 0 dist 7.53504 9.64124 6.89722 16.3948 10.4716 9.96396 16.7713 13.0088 8.26458 7.04044 numMergedOcc 0
24 mol 73 unq 18 iso 0 dist 7.53504 9.64124 6.89722 11.801 5.2774 6.19304 16.7713 13.0088 8.26458 8.73253 numMergedOcc 0
25 mol 73 unq 19 iso 0 dist 7.53504 9.64124 6.89722 12.2721 13.9156 8.70481 20.7558 20.6347 14.8866 8.85586 numMergedOcc 0
26 mol 73 unq 20 iso 0 dist 7.53504 9.64124 6.89722 12.2721 13.9156 8.70481 16.2788 14.6904 8.05119 7.11 numMergedOcc 0
27 mol 73 unq 21 iso 0 dist 8.66342 16.8585 9.68526 16.3948 8.31041 9.38498 16.7713 10.5067 15.7304 7.04044 numMergedOcc 0
28 mol 73 unq 22 iso 0 dist 8.66342 9.64124 7.26679 16.3948 8.31041 9.96396 16.7713 10.5067 8.26458 7.04044 numMergedOcc 0
29 mol 73 unq 23 iso 0 dist 8.66342 9.64124 7.26679 11.801 5.44275 6.19304 16.7713 10.5067 8.26458 8.73253 numMergedOcc 0
30 mol 73 unq 24 iso 0 dist 8.66342 9.64124 7.26679 12.2721 11.2674 8.70481 20.7558 17.0516 14.8866 8.85586 numMergedOcc 0
31 mol 73 unq 25 iso 0 dist 8.66342 9.64124 7.26679 12.2721 11.2674 8.70481 16.2788 12.9368 8.05119 7.11 numMergedOcc 0
32 mol 73 unq 26 iso 0 dist 8.66342 16.0481 9.30776 16.3948 8.31041 9.75218 16.7713 10.5067 8.35241 7.04044 numMergedOcc 0
33 mol 73 unq 27 iso 0 dist 7.21285 16.8585 9.72442 16.3948 11.7069 9.38498 16.7713 14.8476 15.7304 7.04044 numMergedOcc 0
34 mol 152 unq 0 iso 0 dist 8.84852 9.50073 9.10619 15.3848 9.66339 8.56324 15.0548 14.8536 9.35627 9.77552 numMergedOcc 0
35 mol 152 unq 1 iso 0 dist 8.84852 9.50073 9.10619 16.0753 13.9994 6.70283 15.0548 14.8536 9.35627 8.28642 numMergedOcc 0
36 mol 175 unq 0 iso 0 dist 8.39634 9.72213 9.00898 13.5463 5.96451 9.29945 6.49088 5.32236 4.24624 8.0154 numMergedOcc 0
37 mol 220 unq 0 iso 0 dist 8.58709 5.1021 9.8711 6.21273 4.90657 9.23153 6.71715 6.50846 6.17628 5.45036 numMergedOcc 0
38 mol 220 unq 1 iso 0 dist 8.58709 5.1021 9.8711 6.21273 4.90657 9.23153 10.938 14.8113 14.0253 9.97586 numMergedOcc 0
39 mol 222 unq 0 iso 0 dist 7.10689 5.01062 8.7347 8.7419 8.81265 6.00706 7.26742 12.5498 6.42798 7.862 numMergedOcc 0
40 mol 224 unq 0 iso 0 dist 7.46044 13.1803 9.75313 10.6043 6.46679 6.61986 12.0413 11.4439 4.59567 8.37597 numMergedOcc 0
41 mol 227 unq 0 iso 0 dist 7.99145 5.841 9.17826 12.9898 14.9329 7.22101 15.8833 13.4281 11.0628 8.38865 numMergedOcc 0
42 mol 227 unq 1 iso 0 dist 7.99145 5.841 9.17826 14.1659 13.2783 8.65997 15.8833 13.4281 11.0628 5.4694 numMergedOcc 0
43 mol 227 unq 2 iso 0 dist 7.99145 5.841 9.17826 7.71761 11.4528 7.55216 8.14937 14.5658 10.6244 5.87815 numMergedOcc 0
44 mol 230 unq 0 iso 0 dist 5.00735 6.33989 8.43766 5.62804 7.07028 6.7547 10.1088 10.3524 6.20661 6.41286 numMergedOcc 0
45 mol 230 unq 1 iso 0 dist 9.27643 6.63414 8.43766 10.8539 7.07028 6.7547 7.81136 10.3524 6.20661 6.41286 numMergedOcc 0
46 mol 248 unq 0 iso 0 dist 7.83878 5.68749 7.66519 12.7933 6.42363 9.56569 10.4208 7.21518 6.71566 6.77954 numMergedOcc 0
47 mol 252 unq 0 iso 0 dist 8.04265 14.8036 9.73021 13.0796 5.26867 7.19638 11.199 6.88874 5.25252 6.86945 numMergedOcc 0
48 mol 252 unq 1 iso 0 dist 9.42193 14.864 9.73021 13.4304 5.26867 7.19638 9.71846 6.88874 5.25252 6.86945 numMergedOcc 0
49 mol 258 unq 0 iso 0 dist 6.59521 5.13233 8.58088 10.7821 10.221 6.60405 12.2193 14.7484 7.42673 6.70815 numMergedOcc 0
50 mol 258 unq 1 iso 0 dist 6.59521 5.13233 8.58088 8.21585 9.22664 6.42289 12.2193 14.7484 7.42673 7.99477 numMergedOcc 0
51 mol 258 unq 2 iso 0 dist 6.59521 5.13233 8.58088 8.21585 9.22664 6.42289 8.45446 13.7217 6.44209 7.86627 numMergedOcc 0
52 mol 259 unq 0 iso 0 dist 9.16791 16.6792 9.58006 18.6945 11.8501 7.46176 15.812 11.5672 5.60748 8.55558 numMergedOcc 0
