0 mol 19 unq 0 iso 0 dist 6.41045 7.64353 4.51865 8.64504 4.44441 7.7312 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.03754 14.0204 8.80331 15.8424 9.86609 7.39848 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.23812 7.80518 8.70481 10.9711 15.1432 7.37171 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 9.20448 14.2474 7.79912 13.5985 4.74027 9.16597 numMergedOcc 0
4 mol 75 unq 1 iso 0 dist 6.96759 13.8905 7.79912 10.4865 4.74027 9.16597 numMergedOcc 0
5 mol 75 unq 2 iso 0 dist 6.97318 11.2774 7.79912 10.9669 4.74027 9.16597 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 5.68286 5.73349 7.9245 10.009 5.34874 9.85512 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 5.68286 5.73349 7.9245 7.50229 3.68023 8.97888 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.67557 6.53819 7.95579 8.00314 8.37717 9.01812 numMergedOcc 0
9 mol 101 unq 0 iso 0 dist 8.65215 9.17843 6.57035 15.9808 7.89838 9.23765 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 9.1987 10.4463 8.54584 16.9353 12.5321 7.97548 numMergedOcc 0
11 mol 129 unq 1 iso 0 dist 9.1987 10.4463 8.54584 18.3881 11.3755 9.64164 numMergedOcc 0
12 mol 129 unq 2 iso 0 dist 9.1987 7.40266 8.53613 16.9353 12.5321 9.9291 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 8.41774 13.1435 8.56324 15.477 9.73449 7.55934 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 7.7544 10.8374 7.81386 11.6986 6.13927 8.29467 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 8.52924 11.993 7.26832 15.8588 13.3822 7.13783 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 8.23381 7.48984 6.97229 12.2102 6.24714 7.12221 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 8.23381 7.48984 6.97229 6.90511 4.02333 5.4557 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 4.81916 7.94155 9.7748 9.07744 7.75371 5.69112 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 4.81916 7.94155 9.7748 12.4905 11.3546 7.2091 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 5.41639 8.26589 6.53701 10.6787 6.87492 6.01897 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 7.96485 8.26589 6.0664 10.6787 3.51781 6.01897 numMergedOcc 0
