0 mol 69 unq 0 iso 0 dist 8.24121 16.9712 9.37094 6.51655 7.04352 13.9612 numMergedOcc 0
1 mol 69 unq 1 iso 0 dist 8.24121 16.9712 9.37094 15.9496 8.1114 4.64762 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 4.24428 6.13631 6.10011 5.14919 5.64598 10.0721 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 6.30194 6.13631 8.124 5.14919 4.65521 10.0721 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 5.49623 6.67981 6.09906 6.26867 7.87814 12.0756 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 9.22376 13.7516 6.56728 13.0379 7.22293 8.46482 numMergedOcc 0
6 mol 94 unq 0 iso 0 dist 9.10488 6.00306 9.35727 7.0184 8.3586 5.96441 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 8.39771 16.9308 9.45397 17.5575 9.20981 5.38332 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 5.97879 9.53071 9.62866 5.84883 6.73814 11.5609 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 7.23052 9.2094 6.35314 10.5562 6.83051 9.93612 numMergedOcc 0
10 mol 124 unq 1 iso 0 dist 7.23052 9.2094 6.35314 12.5603 9.28376 9.06209 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 5.67862 6.50741 7.27598 6.30187 5.42582 7.26771 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 7.97208 6.50741 5.57904 6.30187 8.6355 7.26771 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 9.41832 12.2179 9.68229 6.92517 6.95323 5.35291 numMergedOcc 0
14 mol 140 unq 1 iso 0 dist 8.36882 7.32877 7.83582 13.9771 8.19104 14.4791 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.9077 11.9931 6.21273 10.4277 6.84247 5.33649 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 8.9077 11.9931 6.21273 12.6281 6.99002 12.5011 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 8.69148 8.37449 5.47561 8.62626 6.82208 11.3364 numMergedOcc 0
18 mol 240 unq 0 iso 0 dist 6.01168 11.1967 9.68888 6.40204 6.15305 13.7594 numMergedOcc 0
19 mol 240 unq 1 iso 0 dist 6.01168 11.1967 9.68888 11.4113 8.0951 5.59975 numMergedOcc 0
20 mol 240 unq 2 iso 0 dist 6.83069 9.79222 9.68888 10.6805 6.15305 13.7594 numMergedOcc 0
21 mol 240 unq 3 iso 0 dist 6.83069 9.79222 9.68888 5.79056 8.0951 5.59975 numMergedOcc 0
22 mol 256 unq 0 iso 0 dist 8.43264 7.68659 5.98967 8.04009 5.24676 6.25507 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 9.67877 16.1624 8.40766 13.6436 6.49982 5.70545 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 7.54805 5.46523 5.3051 8.3872 6.34034 6.10503 numMergedOcc 0
25 mol 272 unq 0 iso 0 dist 6.62923 11.1133 7.31993 6.99865 9.09992 13.7563 numMergedOcc 0
26 mol 272 unq 1 iso 0 dist 6.62923 11.1133 7.31993 10.3424 6.16449 5.91451 numMergedOcc 0
