0 mol 5 unq 0 iso 0 dist 9.7907 7.88567 3.99476 4.8206 11.2534 8.19185 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.38646 9.45451 4.09467 13.4347 12.3461 9.05556 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.90359 8.98746 12.7162 8.65597 16.7441 6.68744 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.6643 9.89914 5.47056 5.90358 6.25751 8.00784 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 6.49242 5.19407 3.76156 4.96022 10.8076 9.58357 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 9.24032 4.5892 5.2335 10.9746 13.5749 9.82679 numMergedOcc 0
6 mol 83 unq 0 iso 0 dist 6.07337 9.98298 5.69217 11.1337 11.2066 9.82018 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 8.09408 6.2753 4.06365 4.47873 11.2923 9.22903 numMergedOcc 0
8 mol 111 unq 0 iso 0 dist 4.86701 8.69371 4.26808 13.0386 8.49242 7.36025 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.77628 4.93944 5.50466 13.1656 8.55099 9.80185 numMergedOcc 0
10 mol 153 unq 0 iso 0 dist 6.11959 6.18934 4.50321 7.11128 11.3606 8.16336 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.03496 7.62945 9.42515 4.29134 9.99867 7.005 numMergedOcc 0
12 mol 274 unq 0 iso 0 dist 9.44207 7.70811 8.42538 4.74285 10.0367 8.23254 numMergedOcc 0
13 mol 278 unq 0 iso 0 dist 9.67619 5.35362 8.48896 9.80648 15.9259 7.45915 numMergedOcc 0
