0 mol 17 unq 0 iso 0 dist 7.96836 8.48453 13.5023 12.9838 17.2477 9.78331 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.49309 8.48453 16.6172 12.9838 17.7963 9.78331 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 9.1695 7.51978 15.6611 13.9555 21.6798 7.21717 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 8.87546 7.28711 10.7033 9.98867 15.703 5.73743 numMergedOcc 0
4 mol 167 unq 0 iso 0 dist 8.68179 6.64164 7.9092 10.2539 14.497 9.67741 numMergedOcc 0
5 mol 167 unq 1 iso 0 dist 5.32056 6.64164 6.45463 10.2539 13.6518 9.67741 numMergedOcc 0
6 mol 167 unq 2 iso 0 dist 9.52659 6.64164 6.67469 10.2539 14.3972 9.67741 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 7.21606 6.96824 5.32364 4.75774 9.2933 5.9176 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 7.21606 6.96824 5.32364 9.91956 8.77781 6.41453 numMergedOcc 0
9 mol 181 unq 2 iso 0 dist 7.21606 9.25528 9.56466 15.4597 14.4154 8.90963 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 9.9479 8.93637 10.7994 12.5597 17.0247 6.59716 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 8.09547 7.2527 4.98461 10.0472 12.1032 7.57812 numMergedOcc 0
12 mol 238 unq 1 iso 0 dist 8.09547 7.2527 4.98461 10.0651 11.0357 8.69104 numMergedOcc 0
13 mol 238 unq 2 iso 0 dist 8.09547 7.13194 13.3052 10.0472 12.1032 9.24557 numMergedOcc 0
14 mol 238 unq 3 iso 0 dist 8.66923 9.29203 15.3346 13.6806 15.6369 7.57812 numMergedOcc 0
15 mol 238 unq 4 iso 0 dist 8.66923 9.29203 15.3346 16.2617 19.8945 8.69104 numMergedOcc 0
16 mol 238 unq 5 iso 0 dist 8.66923 7.80166 7.04671 13.6806 15.6369 9.24557 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 7.32876 7.22378 5.38982 4.39424 7.87648 7.21311 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 9.71269 7.28096 5.09322 12.4113 10.9565 6.89451 numMergedOcc 0
19 mol 287 unq 1 iso 0 dist 9.40407 7.28096 12.3043 12.4113 16.1408 6.89451 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 9.71269 7.28096 5.09322 12.4113 10.9565 6.89451 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 9.40407 7.28096 12.3043 12.4113 16.1408 6.89451 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 9.71269 7.28096 5.09322 12.4113 10.9565 6.89451 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 9.40407 7.28096 12.3043 12.4113 16.1408 6.89451 numMergedOcc 0
