0 mol 12 unq 0 iso 0 dist 8.98466 5.9021 12.3127 6.6051 10.763 4.86727 8.5421 7.96154 14.2972 13.3275 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 9.79426 9.3147 17.1338 8.75001 12.053 10.2713 9.27965 9.55978 18.5363 15.5374 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 9.50179 6.72231 7.62467 8.6232 5.89271 5.10048 8.82295 8.62855 12.312 12.5522 numMergedOcc 0
3 mol 134 unq 0 iso 0 dist 7.85526 5.33543 5.63574 9.88178 6.01484 10.6104 5.57607 7.94564 9.21999 6.00896 numMergedOcc 0
4 mol 134 unq 1 iso 0 dist 5.33543 7.85526 5.63574 9.88178 10.6104 6.01484 5.57607 9.21999 7.94564 6.00896 numMergedOcc 0
5 mol 220 unq 0 iso 0 dist 7.57712 7.20255 5.88344 5.25149 10.1832 9.96224 6.40358 4.3362 5.51565 10.8891 numMergedOcc 0
6 mol 220 unq 1 iso 0 dist 7.57712 7.20255 5.88344 8.6368 13.4455 8.70221 6.40358 4.3362 5.51565 11.0474 numMergedOcc 0
7 mol 220 unq 2 iso 0 dist 7.20255 7.57712 5.88344 5.25149 9.96224 10.1832 6.40358 5.51565 4.3362 10.8891 numMergedOcc 0
8 mol 220 unq 3 iso 0 dist 7.20255 7.57712 5.88344 5.25149 9.96224 10.1832 7.36665 9.74776 10.181 12.5698 numMergedOcc 0
9 mol 220 unq 4 iso 0 dist 7.20255 7.57712 5.88344 8.6368 8.70221 13.4455 6.40358 5.51565 4.3362 11.0474 numMergedOcc 0
10 mol 220 unq 5 iso 0 dist 7.20255 7.57712 5.88344 8.6368 8.70221 13.4455 7.36665 9.74776 10.181 9.984 numMergedOcc 0
11 mol 220 unq 6 iso 0 dist 7.57716 8.98362 13.3644 6.50756 8.34243 5.82963 7.52634 9.41713 15.8264 12.052 numMergedOcc 0
12 mol 223 unq 0 iso 0 dist 9.29204 9.14789 4.44825 6.97426 4.73988 4.78255 4.68566 9.86372 7.70946 7.96628 numMergedOcc 0
13 mol 223 unq 1 iso 0 dist 9.29204 9.14789 4.44825 8.87456 8.36102 5.43913 4.68566 9.86372 7.70946 7.76053 numMergedOcc 0
14 mol 223 unq 2 iso 0 dist 9.29204 7.80764 16.0208 6.97426 4.73988 12.6805 4.68566 9.86372 11.3699 7.96628 numMergedOcc 0
15 mol 223 unq 3 iso 0 dist 9.29204 7.80764 16.0208 8.87456 8.36102 13.9763 4.68566 9.86372 11.3699 7.76053 numMergedOcc 0
16 mol 223 unq 4 iso 0 dist 9.29204 5.75896 11.898 6.97426 4.73988 10.6184 4.68566 9.86372 10.1945 7.96628 numMergedOcc 0
17 mol 223 unq 5 iso 0 dist 9.29204 5.75896 11.898 8.87456 8.36102 13.8469 4.68566 9.86372 10.1945 7.76053 numMergedOcc 0
18 mol 223 unq 6 iso 0 dist 9.14789 9.29204 4.44825 6.97426 4.78255 4.73988 4.68566 7.70946 9.86372 7.96628 numMergedOcc 0
19 mol 223 unq 7 iso 0 dist 9.14789 9.29204 4.44825 8.87456 5.43913 8.36102 4.68566 7.70946 9.86372 7.76053 numMergedOcc 0
20 mol 223 unq 8 iso 0 dist 9.14789 7.80764 16.2327 6.97426 4.78255 12.6805 4.68566 7.70946 11.3699 7.96628 numMergedOcc 0
21 mol 223 unq 9 iso 0 dist 9.14789 7.80764 16.2327 8.87456 5.43913 13.9763 4.68566 7.70946 11.3699 7.76053 numMergedOcc 0
22 mol 223 unq 10 iso 0 dist 9.14789 5.75896 13.5741 6.97426 4.78255 10.6184 4.68566 7.70946 10.1945 7.96628 numMergedOcc 0
23 mol 223 unq 11 iso 0 dist 9.14789 5.75896 13.5741 8.87456 5.43913 13.8469 4.68566 7.70946 10.1945 7.76053 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 9.37276 5.97988 8.07582 8.81063 4.19878 10.0093 5.07348 8.62228 9.14793 7.53412 numMergedOcc 0
25 mol 249 unq 0 iso 0 dist 7.58833 9.04715 7.46941 3.67935 4.88298 5.75331 6.13333 6.04688 9.50034 5.70674 numMergedOcc 0
26 mol 249 unq 1 iso 0 dist 7.58833 9.04715 7.46941 8.00386 10.9665 5.52082 6.13333 6.04688 9.50034 10.464 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 6.08181 7.70189 9.86352 8.10903 10.8957 5.27718 11.1086 9.26487 17.4434 18.7825 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 6.08181 7.70189 9.86352 7.25618 11.0025 9.46467 11.1086 9.26487 17.4434 17.1978 numMergedOcc 0
29 mol 258 unq 2 iso 0 dist 7.70189 6.08181 9.86352 8.10903 5.27718 10.8957 5.79358 6.59521 10.9114 8.73425 numMergedOcc 0
30 mol 258 unq 3 iso 0 dist 7.70189 6.08181 9.86352 7.25618 9.46467 11.0025 5.79358 6.59521 10.9114 9.65711 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 8.91916 4.55368 4.70261 8.54422 6.40534 6.14631 15.0643 9.2772 11.5263 15.4339 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 8.91916 4.55368 4.70261 7.67473 9.57286 6.89689 15.0643 9.2772 11.5263 17.4248 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 5.78017 8.78203 10.71 8.03486 7.78018 5.38411 4.77763 8.36655 10.6842 11.6898 numMergedOcc 0
34 mol 279 unq 1 iso 0 dist 8.78203 5.78017 10.71 8.03486 5.38411 7.78018 12.3869 8.76889 15.937 13.774 numMergedOcc 0
35 mol 279 unq 2 iso 0 dist 8.78203 5.78017 10.71 8.03486 5.38411 7.78018 7.27825 7.04397 12.2658 10.4088 numMergedOcc 0
