0 mol 9 unq 0 iso 0 dist 9.47063 8.14998 13.4984 6.96891 10.9812 6.59312 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 5.96346 6.84216 6.76736 10.7734 7.98326 9.81983 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 9.78331 8.70792 6.43075 4.03817 7.92012 5.16502 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.70827 8.23075 12.2271 5.11617 12.8389 7.85986 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.70827 4.7841 12.6431 4.50066 11.8282 7.03544 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.70827 4.7841 12.6431 5.11617 12.8389 4.30252 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 6.73939 8.23075 12.2839 5.11617 6.72323 7.85986 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 6.73939 4.7841 6.22954 4.50066 4.2121 7.03544 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 6.73939 4.7841 6.22954 5.11617 6.72323 4.30252 numMergedOcc 0
9 mol 36 unq 0 iso 0 dist 8.07928 5.79779 3.94298 5.52411 10.8682 8.37681 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 9.92355 9.23438 8.76454 10.2049 10.2007 6.41008 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 7.68678 7.17488 8.76454 5.49591 10.2007 6.41008 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 5.37007 4.17838 3.77771 7.05542 10.9574 8.43964 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 6.65501 7.92856 11.6496 14.1056 20.0157 9.90672 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 6.65501 7.92856 11.6496 14.3413 16.102 7.55367 numMergedOcc 0
15 mol 102 unq 0 iso 0 dist 8.31932 5.54256 7.28191 4.48396 8.88394 6.07633 numMergedOcc 0
16 mol 113 unq 0 iso 0 dist 8.8822 7.02367 5.40648 7.27193 6.6317 9.62952 numMergedOcc 0
17 mol 113 unq 1 iso 0 dist 9.66219 7.02367 3.52111 7.27193 10.0094 9.62952 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.99399 7.60162 5.77063 7.45148 7.20249 6.21165 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 8.78276 8.81797 3.88766 6.66056 10.6254 8.00013 numMergedOcc 0
20 mol 130 unq 1 iso 0 dist 7.88805 9.81269 3.88766 10.7785 10.6254 8.00013 numMergedOcc 0
21 mol 130 unq 2 iso 0 dist 7.96646 5.92733 3.88766 7.11959 10.6254 8.00013 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 6.22122 9.70481 13.4378 11.85 12.1629 9.20617 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 5.44002 7.13783 4.76454 9.55992 10.6839 7.75318 numMergedOcc 0
24 mol 206 unq 0 iso 0 dist 6.16414 4.51255 9.36584 4.62682 10.7298 5.17607 numMergedOcc 0
25 mol 206 unq 1 iso 0 dist 7.75885 6.23183 9.36584 7.67029 10.7298 5.17607 numMergedOcc 0
26 mol 206 unq 2 iso 0 dist 7.33701 4.51255 8.97305 4.62682 10.985 5.17607 numMergedOcc 0
27 mol 206 unq 3 iso 0 dist 8.0871 4.51255 8.90838 4.62682 9.9584 5.17607 numMergedOcc 0
28 mol 232 unq 0 iso 0 dist 9.05071 8.25985 12.159 4.9377 9.8664 9.78273 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 7.6595 5.4557 7.26991 6.93678 11.1811 7.08328 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 9.65934 5.30118 5.39801 6.56801 10.3435 8.58427 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 9.65934 5.30118 5.39801 6.56801 10.3435 8.58427 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 9.65934 5.30118 5.39801 6.56801 10.3435 8.58427 numMergedOcc 0
