0 mol 16 unq 0 iso 0 dist 8.17898 8.17747 9.30471 5.37568 6.42835 3.83262 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.17898 8.17747 9.30471 9.62324 6.57331 5.7598 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 7.57586 4.54616 9.30722 5.45205 9.19165 6.31143 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 8.62769 11.0441 9.20429 5.17091 7.16132 12.9186 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 6.09782 9.19015 9.20429 10.763 7.16132 12.9186 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 9.10915 14.1348 8.75668 6.24019 9.86334 11.5793 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 8.66921 14.7285 8.75668 7.01498 9.86334 11.5793 numMergedOcc 0
7 mol 64 unq 2 iso 0 dist 5.54343 8.45243 8.75668 5.18166 9.86334 11.5793 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 6.87176 5.48662 7.89424 8.41932 7.39665 3.89663 numMergedOcc 0
9 mol 68 unq 1 iso 0 dist 7.45675 12.5241 9.27389 11.3486 6.17207 5.18148 numMergedOcc 0
10 mol 68 unq 2 iso 0 dist 5.57389 8.46933 7.89424 8.95801 7.39665 3.89663 numMergedOcc 0
11 mol 95 unq 0 iso 0 dist 9.40559 10.1023 9.64673 12.698 9.3948 10.6733 numMergedOcc 0
12 mol 95 unq 1 iso 0 dist 9.40559 10.1023 9.64673 12.5563 9.74607 15.954 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 5.67862 5.4503 6.48328 7.77359 9.33924 9.80637 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 5.67862 5.4503 6.48328 10.8891 7.93372 7.07082 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 9.04554 6.12711 6.36439 5.93188 8.33439 7.59527 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.42819 7.51816 7.69229 8.39434 7.37333 6.69138 numMergedOcc 0
17 mol 162 unq 1 iso 0 dist 9.42819 7.51816 7.69229 4.92282 7.45998 6.82744 numMergedOcc 0
18 mol 180 unq 0 iso 0 dist 7.08676 4.57551 7.71517 5.83274 8.82325 5.66123 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 7.7292 15.6012 9.44947 5.99091 7.9133 14.13 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 9.40003 14.5553 9.92165 7.66602 7.46481 14.5969 numMergedOcc 0
21 mol 214 unq 1 iso 0 dist 8.68385 9.87974 9.92165 15.5553 7.46481 14.5969 numMergedOcc 0
22 mol 217 unq 0 iso 0 dist 5.10683 7.49329 6.23025 5.27109 7.60269 4.76575 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 7.27481 12.6107 6.77368 12.9462 6.74196 4.54951 numMergedOcc 0
24 mol 222 unq 1 iso 0 dist 7.27481 12.6107 6.77368 9.50604 8.36842 10.5815 numMergedOcc 0
25 mol 222 unq 2 iso 0 dist 7.27481 12.6107 6.77368 9.68195 9.75472 10.7456 numMergedOcc 0
26 mol 222 unq 3 iso 0 dist 7.27481 4.98993 7.73634 12.9462 6.74196 11.1253 numMergedOcc 0
27 mol 222 unq 4 iso 0 dist 7.27481 4.98993 7.73634 9.50604 8.36842 5.10026 numMergedOcc 0
28 mol 222 unq 5 iso 0 dist 7.27481 4.98993 7.73634 9.68195 9.75472 5.90399 numMergedOcc 0
29 mol 236 unq 0 iso 0 dist 6.36941 13.8826 7.87233 5.3331 9.3206 16.5242 numMergedOcc 0
30 mol 280 unq 0 iso 0 dist 9.26066 4.68825 5.41639 8.13853 6.02353 4.06908 numMergedOcc 0
