0 mol 68 unq 0 iso 0 dist 5.04007 8.59945 5.9436 7.29121 7.42839 5.98721 numMergedOcc 0
1 mol 68 unq 1 iso 0 dist 5.04007 8.59945 5.9436 8.35847 10.2527 9.66249 numMergedOcc 0
2 mol 68 unq 2 iso 0 dist 6.60395 8.59945 12.7236 7.29121 11.3775 5.98721 numMergedOcc 0
3 mol 68 unq 3 iso 0 dist 6.60395 8.59945 12.7236 8.35847 12.265 9.66249 numMergedOcc 0
4 mol 168 unq 0 iso 0 dist 8.66519 8.80059 11.5281 8.96534 16.3246 16.2709 numMergedOcc 0
5 mol 168 unq 1 iso 0 dist 8.66519 8.80059 11.5281 8.65328 17.2974 12.6805 numMergedOcc 0
6 mol 168 unq 2 iso 0 dist 8.66519 8.80059 11.5281 5.69346 7.95609 7.61798 numMergedOcc 0
7 mol 224 unq 0 iso 0 dist 9.02319 9.97204 6.30991 8.55819 16.5165 18.1408 numMergedOcc 0
8 mol 224 unq 1 iso 0 dist 9.86201 9.97204 19.7048 8.55819 4.69994 18.1408 numMergedOcc 0
9 mol 257 unq 0 iso 0 dist 9.91996 9.34175 16.2217 7.57749 8.98591 8.56997 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 5.50553 9.43704 9.58448 8.34536 7.23383 6.44203 numMergedOcc 0
11 mol 258 unq 1 iso 0 dist 5.50553 7.41653 7.71103 8.34536 7.23383 12.4315 numMergedOcc 0
12 mol 259 unq 0 iso 0 dist 9.98041 9.98231 7.39099 9.93282 10.9987 4.47425 numMergedOcc 0
13 mol 259 unq 1 iso 0 dist 9.98041 9.98231 7.39099 8.90555 8.41608 4.10176 numMergedOcc 0
14 mol 259 unq 2 iso 0 dist 8.43646 9.98231 11.2736 9.93282 10.8479 4.47425 numMergedOcc 0
15 mol 259 unq 3 iso 0 dist 8.43646 9.98231 11.2736 8.90555 7.94707 4.10176 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 5.16772 7.23618 10.7169 7.97307 11.432 9.07649 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 5.16772 7.23618 10.7169 8.52702 4.35925 14.885 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 8.78501 6.99089 14.3041 8.6959 5.85295 12.359 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 5.59641 6.99089 9.63118 8.6959 10.8026 12.359 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 6.08524 8.56844 5.39579 6.66483 6.30689 10.1327 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 6.28768 8.2053 10.5372 5.31969 9.09436 3.97454 numMergedOcc 0
