0 mol 43 unq 0 iso 0 dist 9.74445 8.75469 8.03754 10.323 8.80331 14.0204 12.8035 9.83618 10.1053 10.4442 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.74445 8.75469 8.03754 14.445 6.20293 13.1056 12.8035 9.83618 10.1053 9.49077 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.62468 12.9303 8.44473 10.7369 6.65721 11.2947 6.91052 8.76003 10.8911 5.83489 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 9.62468 12.9303 8.44473 11.5608 6.72123 4.78811 6.91052 8.76003 10.8911 7.39396 numMergedOcc 0
4 mol 61 unq 2 iso 0 dist 5.92705 13.2942 8.44473 5.4671 6.65721 11.2947 7.34319 8.76003 10.8911 5.83489 numMergedOcc 0
5 mol 61 unq 3 iso 0 dist 5.92705 13.2942 8.44473 10.1513 6.72123 4.78811 7.34319 8.76003 10.8911 7.39396 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 9.10619 7.53439 8.41774 9.66339 8.56324 13.1435 10.5988 9.13561 10.8622 5.99333 numMergedOcc 0
7 mol 152 unq 1 iso 0 dist 9.10619 7.53439 8.41774 13.9994 6.70283 13.793 10.5988 9.13561 10.8622 8.25411 numMergedOcc 0
8 mol 152 unq 2 iso 0 dist 9.10619 7.53439 8.41774 14.2552 7.16148 11.2124 10.5988 9.13561 10.8622 7.89109 numMergedOcc 0
9 mol 178 unq 0 iso 0 dist 8.0974 11.7183 9.63185 12.2822 6.69288 14.4816 11.6559 8.96511 6.70227 10.5783 numMergedOcc 0
10 mol 178 unq 1 iso 0 dist 8.0974 11.7183 9.63185 12.4338 6.43573 10.2893 11.6559 8.96511 6.70227 5.96647 numMergedOcc 0
11 mol 178 unq 2 iso 0 dist 8.0974 11.7183 9.63185 13.9722 7.17202 9.7684 11.6559 8.96511 6.70227 12.075 numMergedOcc 0
12 mol 178 unq 3 iso 0 dist 8.0974 11.7183 9.63185 13.5599 8.81551 5.37264 11.6559 8.96511 6.70227 9.92132 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 8.49704 17.1631 9.92165 12.4611 9.65138 10.1227 13.4309 6.97182 4.40728 6.16485 numMergedOcc 0
14 mol 214 unq 1 iso 0 dist 8.49704 17.1631 9.92165 12.4611 9.65138 10.1227 13.5787 6.1175 5.75872 11.5712 numMergedOcc 0
15 mol 214 unq 2 iso 0 dist 8.49704 17.1631 9.92165 11.832 7.14453 6.83063 13.4309 6.97182 4.40728 5.33565 numMergedOcc 0
16 mol 214 unq 3 iso 0 dist 8.49704 17.1631 9.92165 11.832 7.14453 6.83063 13.5787 6.1175 5.75872 5.06792 numMergedOcc 0
17 mol 214 unq 4 iso 0 dist 8.49704 17.1631 9.92165 10.644 8.85478 12.7439 13.4309 6.97182 4.40728 8.47007 numMergedOcc 0
18 mol 214 unq 5 iso 0 dist 8.49704 17.1631 9.92165 10.644 8.85478 12.7439 13.5787 6.1175 5.75872 12.8334 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 7.31105 10.1832 5.39218 14.6296 9.23153 13.3213 12.3402 6.84247 9.46015 6.7067 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 7.31105 10.1832 5.39218 14.6296 9.23153 13.3213 7.84277 6.99002 4.51612 15.9568 numMergedOcc 0
21 mol 220 unq 2 iso 0 dist 7.31105 10.1832 5.39218 9.52692 8.24498 11.4842 12.3402 6.84247 9.46015 6.05129 numMergedOcc 0
22 mol 220 unq 3 iso 0 dist 7.31105 10.1832 5.39218 9.52692 8.24498 11.4842 7.84277 6.99002 4.51612 11.1321 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 6.56437 11.5364 7.49783 14.2632 8.95269 12.8561 11.7838 7.06793 4.76056 9.36098 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 6.56437 11.5364 7.49783 14.2632 8.95269 12.8561 10.4999 6.67585 10.7068 5.29877 numMergedOcc 0
25 mol 224 unq 2 iso 0 dist 6.23882 6.88745 7.49783 15.0038 8.95269 12.8561 9.57742 7.06793 4.76056 9.36098 numMergedOcc 0
26 mol 224 unq 3 iso 0 dist 6.23882 6.88745 7.49783 15.0038 8.95269 12.8561 12.0368 6.67585 10.7068 5.29877 numMergedOcc 0
27 mol 224 unq 4 iso 0 dist 9.53131 12.1666 7.49783 9.59595 8.95269 12.8561 8.30442 7.06793 4.76056 9.36098 numMergedOcc 0
28 mol 224 unq 5 iso 0 dist 9.53131 12.1666 7.49783 9.59595 8.95269 12.8561 4.63666 6.67585 10.7068 5.29877 numMergedOcc 0
29 mol 224 unq 6 iso 0 dist 9.34636 9.9943 7.49783 5.63485 8.95269 12.8561 5.46434 7.06793 4.76056 9.36098 numMergedOcc 0
30 mol 224 unq 7 iso 0 dist 9.34636 9.9943 7.49783 5.63485 8.95269 12.8561 5.03449 6.67585 10.7068 5.29877 numMergedOcc 0
31 mol 249 unq 0 iso 0 dist 7.29898 10.254 6.26142 6.6173 7.57994 5.59015 4.16447 8.83735 10.0505 5.23473 numMergedOcc 0
32 mol 249 unq 1 iso 0 dist 7.29898 10.254 6.26142 8.95486 6.18582 4.77325 4.16447 8.83735 10.0505 7.38675 numMergedOcc 0
33 mol 249 unq 2 iso 0 dist 8.91685 8.81984 6.26142 5.25611 7.57994 5.59015 6.74838 8.83735 10.0505 5.23473 numMergedOcc 0
34 mol 249 unq 3 iso 0 dist 8.91685 8.81984 6.26142 9.66184 6.18582 4.77325 6.74838 8.83735 10.0505 7.38675 numMergedOcc 0
35 mol 277 unq 0 iso 0 dist 6.90434 5.95045 4.81916 13.2927 9.7748 7.94155 9.14131 9.41725 6.20663 6.58374 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 5.67266 8.78407 7.71088 9.63727 8.04483 5.86383 5.41716 8.8673 6.7858 10.1236 numMergedOcc 0
37 mol 282 unq 1 iso 0 dist 5.67266 8.78407 7.71088 4.58403 8.76532 11.2986 5.41716 8.8673 6.7858 8.14825 numMergedOcc 0
38 mol 282 unq 2 iso 0 dist 5.67266 8.78407 7.71088 5.04235 6.33524 7.46064 5.41716 8.8673 6.7858 7.36881 numMergedOcc 0
39 mol 282 unq 3 iso 0 dist 5.80981 5.33059 7.71088 9.60898 8.04483 5.86383 5.37323 8.8673 6.7858 10.1236 numMergedOcc 0
40 mol 282 unq 4 iso 0 dist 5.80981 5.33059 7.71088 10.5698 8.76532 11.2986 5.37323 8.8673 6.7858 8.14825 numMergedOcc 0
41 mol 282 unq 5 iso 0 dist 5.80981 5.33059 7.71088 8.37652 6.33524 7.46064 5.37323 8.8673 6.7858 7.36881 numMergedOcc 0
42 mol 282 unq 6 iso 0 dist 9.63346 9.73996 7.71088 4.85461 8.04483 5.86383 14.5422 8.8673 6.7858 10.1236 numMergedOcc 0
43 mol 282 unq 7 iso 0 dist 9.63346 9.73996 7.71088 13.108 8.76532 11.2986 14.5422 8.8673 6.7858 8.14825 numMergedOcc 0
44 mol 282 unq 8 iso 0 dist 9.63346 9.73996 7.71088 8.85797 6.33524 7.46064 14.5422 8.8673 6.7858 7.36881 numMergedOcc 0
