0 mol 26 unq 0 iso 0 dist 9.07029 9.90242 4.02057 7.54726 8.6112 11.5426 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.30547 6.46901 6.97513 16.7996 9.47718 16.3923 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 4.9418 9.71805 8.6162 12.2608 9.57953 16.2601 numMergedOcc 0
3 mol 103 unq 1 iso 0 dist 4.9418 5.7953 7.44304 12.2608 9.57953 11.7787 numMergedOcc 0
4 mol 123 unq 0 iso 0 dist 6.9952 9.30054 9.9673 4.18707 6.4879 12.7704 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 6.74947 8.47476 15.1471 8.24148 9.70977 13.8213 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 5.67586 7.53235 7.22219 9.67496 7.10223 13.7615 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 7.75061 9.11609 13.7814 10.0711 9.70481 19.1238 numMergedOcc 0
8 mol 176 unq 1 iso 0 dist 7.75061 8.85187 14.4384 10.0711 9.70481 18.7673 numMergedOcc 0
9 mol 176 unq 2 iso 0 dist 7.75061 9.44083 4.22281 10.0711 9.70481 6.59532 numMergedOcc 0
10 mol 176 unq 3 iso 0 dist 9.44083 7.75061 4.22281 10.0711 6.59532 9.70481 numMergedOcc 0
11 mol 176 unq 4 iso 0 dist 9.44083 9.11609 17.1614 10.0711 6.59532 19.1238 numMergedOcc 0
12 mol 176 unq 5 iso 0 dist 9.44083 8.85187 17.2989 10.0711 6.59532 18.7673 numMergedOcc 0
13 mol 176 unq 6 iso 0 dist 8.12533 9.42768 3.65834 4.60703 9.70481 10.83 numMergedOcc 0
14 mol 176 unq 7 iso 0 dist 8.12533 7.0591 4.22281 4.60703 9.70481 6.59532 numMergedOcc 0
15 mol 176 unq 8 iso 0 dist 7.0591 9.42768 5.22027 4.60703 6.59532 10.83 numMergedOcc 0
16 mol 176 unq 9 iso 0 dist 7.0591 8.12533 4.22281 4.60703 6.59532 9.70481 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 6.32064 5.29176 3.78668 9.38974 9.91429 11.3502 numMergedOcc 0
18 mol 226 unq 0 iso 0 dist 6.67272 9.45332 6.89 5.70516 9.37229 13.8614 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 8.36772 8.83541 9.80429 11.7337 9.80133 16.3355 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 8.36772 7.55878 8.84841 11.7337 9.80133 16.6885 numMergedOcc 0
21 mol 233 unq 2 iso 0 dist 7.55878 8.36772 8.84841 3.73772 7.74693 10.0828 numMergedOcc 0
22 mol 233 unq 3 iso 0 dist 7.55878 8.83541 9.74377 3.73772 7.74693 12.2189 numMergedOcc 0
23 mol 235 unq 0 iso 0 dist 6.91126 9.48967 13.6805 9.7911 8.92054 12.1257 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 8.79625 9.9609 17.5663 4.46246 7.79408 14.1798 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 6.76034 8.1804 4.3594 4.07981 9.87259 10.6354 numMergedOcc 0
26 mol 292 unq 1 iso 0 dist 6.76034 8.1804 4.3594 8.56129 7.7557 11.2973 numMergedOcc 0
