0 mol 1 unq 0 iso 0 dist 9.19543 9.34725 7.80436 7.68779 6.13271 11.5373 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.19543 9.30501 8.71903 7.68779 6.13271 4.58277 numMergedOcc 0
2 mol 36 unq 0 iso 0 dist 5.85008 6.9099 5.81511 8.05598 6.26111 5.25025 numMergedOcc 0
3 mol 36 unq 1 iso 0 dist 9.54644 7.23823 5.81511 7.34019 6.26111 5.25025 numMergedOcc 0
4 mol 36 unq 2 iso 0 dist 9.54644 7.23823 5.81511 8.43828 14.9059 11.6749 numMergedOcc 0
5 mol 53 unq 0 iso 0 dist 6.76484 6.86092 10.7224 7.80805 4.43656 8.38029 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 6.46263 9.1695 9.66182 7.51978 9.65953 15.6611 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 8.29606 7.45482 6.52096 9.99643 6.63565 4.78811 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 8.09075 7.45482 9.50418 9.99643 9.0032 4.78811 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 9.23907 8.87546 15.1931 7.28711 5.27581 10.7033 numMergedOcc 0
10 mol 110 unq 0 iso 0 dist 8.74224 8.38998 6.90066 6.59361 4.65767 8.63598 numMergedOcc 0
11 mol 110 unq 1 iso 0 dist 5.33139 8.38998 4.06845 6.59361 5.33778 8.63598 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 7.62006 6.26373 4.91302 4.93984 7.01116 4.70374 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 7.62006 8.94308 9.05341 4.93984 7.01116 6.05722 numMergedOcc 0
14 mol 167 unq 2 iso 0 dist 7.62006 9.74227 11.4194 4.93984 7.01116 8.90206 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.24101 8.09547 13.523 7.2527 10.2134 4.98461 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 7.24101 8.09547 13.523 7.13194 5.88384 13.3052 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 9.8256 7.32876 4.22701 7.22378 6.62225 5.38982 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 7.07268 8.12646 4.15537 8.27977 4.51764 8.00087 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.26294 9.71269 10.6262 7.28096 11.2095 5.09322 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 7.26294 9.40407 4.93431 7.28096 11.2095 12.3043 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.26294 9.71269 10.6262 7.28096 11.2095 5.09322 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 7.26294 9.40407 4.93431 7.28096 11.2095 12.3043 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 7.26294 9.71269 10.6262 7.28096 11.2095 5.09322 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 7.26294 9.40407 4.93431 7.28096 11.2095 12.3043 numMergedOcc 0
