0 mol 41 unq 0 iso 0 dist 8.45063 5.31016 12.5752 8.62288 8.28673 13.7632 numMergedOcc 0
1 mol 103 unq 0 iso 0 dist 8.1375 9.13032 7.38666 5.42278 7.57822 11.7527 numMergedOcc 0
2 mol 163 unq 0 iso 0 dist 8.66172 9.62943 11.3247 10.2273 9.85967 14.4975 numMergedOcc 0
3 mol 171 unq 0 iso 0 dist 6.20851 6.21194 6.4423 14.0871 9.47945 14.3833 numMergedOcc 0
4 mol 175 unq 0 iso 0 dist 7.7013 7.42278 7.04147 14.2738 8.6609 10.7245 numMergedOcc 0
5 mol 175 unq 1 iso 0 dist 7.7013 7.42278 7.04147 8.62822 6.21546 8.57607 numMergedOcc 0
6 mol 175 unq 2 iso 0 dist 7.7013 7.42278 7.04147 7.44933 6.03184 11.4305 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 5.83898 9.20646 8.30089 8.56706 9.08767 11.8551 numMergedOcc 0
8 mol 219 unq 0 iso 0 dist 8.55971 7.13099 4.06981 5.67196 9.09462 10.1756 numMergedOcc 0
9 mol 219 unq 1 iso 0 dist 7.26376 7.13099 6.66401 6.90398 4.67452 9.30312 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 8.55805 6.32097 5.45485 12.6024 7.35148 12.2602 numMergedOcc 0
11 mol 223 unq 0 iso 0 dist 7.29418 7.81769 5.25583 5.59816 6.03408 6.64193 numMergedOcc 0
12 mol 223 unq 1 iso 0 dist 8.63099 7.66694 5.25583 4.04961 6.03408 6.64193 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 5.6568 8.37813 8.52618 10.0728 7.6402 13.7846 numMergedOcc 0
14 mol 236 unq 1 iso 0 dist 5.6568 9.25988 7.35248 10.0728 7.6402 13.5036 numMergedOcc 0
15 mol 249 unq 0 iso 0 dist 5.96492 6.58109 5.46606 5.34664 4.46389 4.68783 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.52903 8.63176 15.1358 13.2258 6.08181 20.2436 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 9.52903 8.63176 15.1358 3.95075 7.70189 12.1556 numMergedOcc 0
