0 mol 26 unq 0 iso 0 dist 5.20647 5.83051 4.93841 5.95398 5.73363 9.41202 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 9.32099 9.99766 4.9754 5.56554 7.78697 9.40719 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 9.99766 9.32099 4.9754 5.56554 9.40719 7.78697 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 5.32407 6.53102 3.81436 6.72942 6.42569 9.13872 numMergedOcc 0
4 mol 33 unq 1 iso 0 dist 5.32407 7.76575 4.59375 6.72942 6.42569 7.27307 numMergedOcc 0
5 mol 33 unq 2 iso 0 dist 5.32407 9.74394 8.78909 6.72942 6.42569 5.73206 numMergedOcc 0
6 mol 33 unq 3 iso 0 dist 6.53102 5.32407 3.81436 6.72942 9.13872 6.42569 numMergedOcc 0
7 mol 33 unq 4 iso 0 dist 6.53102 7.76575 3.8653 6.72942 9.13872 7.27307 numMergedOcc 0
8 mol 33 unq 5 iso 0 dist 6.53102 9.74394 9.45612 6.72942 9.13872 5.73206 numMergedOcc 0
9 mol 33 unq 6 iso 0 dist 7.76575 5.32407 4.59375 6.72942 7.27307 6.42569 numMergedOcc 0
10 mol 33 unq 7 iso 0 dist 7.76575 6.53102 3.8653 6.72942 7.27307 9.13872 numMergedOcc 0
11 mol 33 unq 8 iso 0 dist 7.76575 9.74394 6.05212 6.72942 7.27307 5.73206 numMergedOcc 0
12 mol 33 unq 9 iso 0 dist 9.74394 5.32407 8.78909 6.72942 5.73206 6.42569 numMergedOcc 0
13 mol 33 unq 10 iso 0 dist 9.74394 6.53102 9.45612 6.72942 5.73206 9.13872 numMergedOcc 0
14 mol 33 unq 11 iso 0 dist 9.74394 7.76575 6.05212 6.72942 5.73206 7.27307 numMergedOcc 0
15 mol 69 unq 0 iso 0 dist 9.08784 8.76979 6.02003 13.3886 9.23947 14.7207 numMergedOcc 0
16 mol 76 unq 0 iso 0 dist 7.98824 9.42329 3.94577 5.1763 9.33989 8.57953 numMergedOcc 0
17 mol 76 unq 1 iso 0 dist 9.42329 7.98824 3.94577 5.1763 8.57953 9.33989 numMergedOcc 0
18 mol 103 unq 0 iso 0 dist 5.7953 9.71805 8.84187 4.71591 8.99759 14.3109 numMergedOcc 0
19 mol 103 unq 1 iso 0 dist 5.7953 4.9418 7.44304 4.71591 8.99759 8.84165 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 6.74947 8.47476 15.1471 12.8281 8.52591 20.7656 numMergedOcc 0
21 mol 154 unq 0 iso 0 dist 5.67586 7.53235 7.22219 12.0362 8.65008 15.8248 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 8.36772 8.83541 9.80429 4.62851 9.72186 8.39315 numMergedOcc 0
23 mol 233 unq 1 iso 0 dist 8.36772 7.55878 8.84841 4.62851 9.72186 11.5286 numMergedOcc 0
24 mol 233 unq 2 iso 0 dist 8.83541 8.36772 9.80429 4.62851 8.39315 9.72186 numMergedOcc 0
25 mol 233 unq 3 iso 0 dist 8.83541 7.55878 9.74377 4.62851 8.39315 11.5286 numMergedOcc 0
26 mol 233 unq 4 iso 0 dist 7.55878 8.36772 8.84841 14.8036 8.01777 16.4452 numMergedOcc 0
27 mol 233 unq 5 iso 0 dist 7.55878 8.83541 9.74377 14.8036 8.01777 16.0587 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 6.58667 6.01542 10.4877 9.78665 8.99435 15.1763 numMergedOcc 0
